N-[(3S,6R)-6-[[(2S)-1-[(2-chloranyl-4-nitro-phenyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]-2,8-dimethyl-4-oxidanylidene-nonan-3-yl]morpholine-4-carboxamide

Systemtic Name: N-[(3S,6R)-6-[[(2S)-1-[(2-chloranyl-4-nitro-phenyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]-2,8-dimethyl-4-oxidanylidene-nonan-3-yl]morpholine-4-carboxamide Openeye Name: N-[(1S,4R)-4-[[(1S)-1-benzyl-2-(2-chloro-4-nitro-anilino)-2-oxo-ethyl]carbamoyl]-1-isopropyl-6-methyl-2-oxo-heptyl]morpholine-4-carboxamide CAS Name: N-[(3S,6R)-6-[[[(2S)-1-(2-chloro-4-nitroanilino)-1-oxo-3-phenylpropan-2-yl]amino]-oxomethyl]-2,8-dimethyl-4-oxononan-3-yl]-4-morpholinecarboxamide IUPAC Name: N-[(3S,6R)-6-[[(2S)-1-(2-chloro-4-nitroanilino)-1-oxo-3-phenylpropan-2-yl]carbamoyl]-2,8-dimethyl-4-oxononan-3-yl]morpholine-4-carboxamide Traditional Name: N-[(1S,4R)-4-[[(1S)-1-benzyl-2-(2-chloro-4-nitro-anilino)-2-keto-ethyl]carbamoyl]-1-isopropyl-2-keto-6-methyl-heptyl]morpholine-4-carboxamide Formula: C32H42ClN5O7 MolecularWeight: 644.15818

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CC(=O)C(C(C)C)NC(=O)N1CCOCC1)C(=O)NC(CC2=CC=CC=C2)C(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)C[C@H](CC(=O)[C@H](C(C)C)NC(=O)N1CCOCC1)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C32H42ClN5O7/c1-20(2)16-23(18-28(39)29(21(3)4)36-32(42)37-12-14-45-15-13-37)30(40)35-27(17-22-8-6-5-7-9-22)31(41)34-26-11-10-24(38(43)44)19-25(26)33/h5-11,19-21,23,27,29H,12-18H2,1-4H3,(H,34,41)(H,35,40)(H,36,42)/t23-,27+,29+/m1/s1