ethyl (E)-7-azanyl-4-[[1-[4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]-3-phenyl-pyrrolidin-2-yl]carbonylamino]-7-oxidanylidene-hept-2-enoate

Systemtic Name: ethyl (E)-7-azanyl-4-[[1-[4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]-3-phenyl-pyrrolidin-2-yl]carbonylamino]-7-oxidanylidene-hept-2-enoate Openeye Name: ethyl (E)-7-amino-4-[[1-[2-(benzyloxycarbonylamino)-4-methyl-pentanoyl]-3-phenyl-pyrrolidine-2-carbonyl]amino]-7-oxo-hept-2-enoate CAS Name: (E)-7-amino-4-[[[1-[4-methyl-1-oxo-2-(phenylmethoxycarbonylamino)pentyl]-3-phenyl-2-pyrrolidinyl]-oxomethyl]amino]-7-oxo-2-heptenoic acid ethyl ester IUPAC Name: ethyl (E)-7-amino-4-[[1-[4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]-3-phenylpyrrolidine-2-carbonyl]amino]-7-oxohept-2-enoate Traditional Name: (E)-7-amino-4-[[1-[2-(benzyloxycarbonylamino)-4-methyl-pentanoyl]-3-phenyl-prolyl]amino]-7-keto-hept-2-enoic acid ethyl ester Formula: C34H44N4O7 MolecularWeight: 620.73576

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(CCC(=O)N)NC(=O)C1C(CCN1C(=O)C(CC(C)C)NC(=O)OCC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)/C=C/C(CCC(=O)N)NC(=O)C1C(CCN1C(=O)C(CC(C)C)NC(=O)OCC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C34H44N4O7/c1-4-44-30(40)18-16-26(15-17-29(35)39)36-32(41)31-27(25-13-9-6-10-14-25)19-20-38(31)33(42)28(21-23(2)3)37-34(43)45-22-24-11-7-5-8-12-24/h5-14,16,18,23,26-28,31H,4,15,17,19-22H2,1-3H3,(H2,35,39)(H,36,41)(H,37,43)/b18-16+