(phenylmethyl) N-[1-[[(2S,3S)-4-[(2S,4S)-2-(tert-butylcarbamoyl)-4-chloranyl-pyrrolidin-1-yl]-3-oxidanyl-4-oxidanylidene-1-phenyl-butan-2-yl]amino]-3-dimethoxyphosphoryl-1-oxidanylidene-butan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-[[(2S,3S)-4-[(2S,4S)-2-(tert-butylcarbamoyl)-4-chloranyl-pyrrolidin-1-yl]-3-oxidanyl-4-oxidanylidene-1-phenyl-butan-2-yl]amino]-3-dimethoxyphosphoryl-1-oxidanylidene-butan-2-yl]carbamate Openeye Name: benzyl N-[1-[[(1S,2S)-1-benzyl-3-[(2S,4S)-2-(tert-butylcarbamoyl)-4-chloro-pyrrolidin-1-yl]-2-hydroxy-3-oxo-propyl]carbamoyl]-2-dimethoxyphosphoryl-propyl]carbamate CAS Name: N-[1-[[(2S,3S)-4-[(2S,4S)-2-[(tert-butylamino)-oxomethyl]-4-chloro-1-pyrrolidinyl]-3-hydroxy-4-oxo-1-phenylbutan-2-yl]amino]-3-dimethoxyphosphoryl-1-oxobutan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-[[(2S,3S)-4-[(2S,4S)-2-(tert-butylcarbamoyl)-4-chloropyrrolidin-1-yl]-3-hydroxy-4-oxo-1-phenylbutan-2-yl]amino]-3-dimethoxyphosphoryl-1-oxobutan-2-yl]carbamate Traditional Name: N-[1-[[(1S,2S)-1-benzyl-3-[(2S,4S)-2-(tert-butylcarbamoyl)-4-chloro-pyrrolidino]-2-hydroxy-3-keto-propyl]carbamoyl]-2-dimethoxyphosphoryl-propyl]carbamic acid benzyl ester Formula: C33H46ClN4O9P MolecularWeight: 709.166501

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)NC(CC1=CC=CC=C1)C(C(=O)N2CC(CC2C(=O)NC(C)(C)C)Cl)O)NC(=O)OCC3=CC=CC=C3)P(=O)(OC)OC

Isomeric SMILES

CC(C(C(=O)N[C@@H](CC1=CC=CC=C1)[C@@H](C(=O)N2C[C@H](C[C@H]2C(=O)NC(C)(C)C)Cl)O)NC(=O)OCC3=CC=CC=C3)P(=O)(OC)OC

InChI

InChI=1S/C33H46ClN4O9P/c1-21(48(44,45-5)46-6)27(36-32(43)47-20-23-15-11-8-12-16-23)30(41)35-25(17-22-13-9-7-10-14-22)28(39)31(42)38-19-24(34)18-26(38)29(40)37-33(2,3)4/h7-16,21,24-28,39H,17-20H2,1-6H3,(H,35,41)(H,36,43)(H,37,40)/t21?,24-,25-,26-,27?,28-/m0/s1