(phenylmethyl) N-[(2S)-1-[(2S)-2-[[(E,3S)-5-cyano-2-methyl-4,6-bis(oxidanyl)hex-5-en-3-yl]carbamoyl]pyrrolidin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-1-[(2S)-2-[[(E,3S)-5-cyano-2-methyl-4,6-bis(oxidanyl)hex-5-en-3-yl]carbamoyl]pyrrolidin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-1-[(2S)-2-[[(E,1S)-3-cyano-2,4-dihydroxy-1-isopropyl-but-3-enyl]carbamoyl]pyrrolidine-1-carbonyl]-2-methyl-propyl]carbamate CAS Name: N-[(2S)-1-[(2S)-2-[[[(E,3S)-5-cyano-4,6-dihydroxy-2-methylhex-5-en-3-yl]amino]-oxomethyl]-1-pyrrolidinyl]-3-methyl-1-oxobutan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-[(2S)-2-[[(E,3S)-5-cyano-4,6-dihydroxy-2-methylhex-5-en-3-yl]carbamoyl]pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]carbamate Traditional Name: N-[(1S)-1-[(2S)-2-[[(E,1S)-3-cyano-2,4-dihydroxy-1-isopropyl-but-3-enyl]carbamoyl]pyrrolidine-1-carbonyl]-2-methyl-propyl]carbamic acid benzyl ester Formula: C26H36N4O6 MolecularWeight: 500.58724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C(=CO)C#N)O)NC(=O)C1CCCN1C(=O)C(C(C)C)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)[C@@H](C(/C(=C/O)/C#N)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C(C)C)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C26H36N4O6/c1-16(2)21(23(32)19(13-27)14-31)28-24(33)20-11-8-12-30(20)25(34)22(17(3)4)29-26(35)36-15-18-9-6-5-7-10-18/h5-7,9-10,14,16-17,20-23,31-32H,8,11-12,15H2,1-4H3,(H,28,33)(H,29,35)/b19-14+/t20-,21-,22-,23?/m0/s1