ethyl (E,4S)-7-azanyl-7-oxidanylidene-4-[2-[2-oxidanylidene-3-(phenylmethoxycarbonylamino)pyridin-1-yl]ethanoylamino]hept-2-enoate

Systemtic Name: ethyl (E,4S)-7-azanyl-7-oxidanylidene-4-[2-[2-oxidanylidene-3-(phenylmethoxycarbonylamino)pyridin-1-yl]ethanoylamino]hept-2-enoate Openeye Name: ethyl (E,4S)-7-amino-4-[[2-[3-(benzyloxycarbonylamino)-2-oxo-1-pyridyl]acetyl]amino]-7-oxo-hept-2-enoate CAS Name: (E,4S)-7-amino-7-oxo-4-[[1-oxo-2-[2-oxo-3-(phenylmethoxycarbonylamino)-1-pyridinyl]ethyl]amino]-2-heptenoic acid ethyl ester IUPAC Name: ethyl (E,4S)-7-amino-7-oxo-4-[[2-[2-oxo-3-(phenylmethoxycarbonylamino)pyridin-1-yl]acetyl]amino]hept-2-enoate Traditional Name: (E,4S)-7-amino-4-[[2-[3-(benzyloxycarbonylamino)-2-keto-1-pyridyl]acetyl]amino]-7-keto-hept-2-enoic acid ethyl ester Formula: C24H28N4O7 MolecularWeight: 484.50172

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(CCC(=O)N)NC(=O)CN1C=CC=C(C1=O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)/C=C/[C@H](CCC(=O)N)NC(=O)CN1C=CC=C(C1=O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C24H28N4O7/c1-2-34-22(31)13-11-18(10-12-20(25)29)26-21(30)15-28-14-6-9-19(23(28)32)27-24(33)35-16-17-7-4-3-5-8-17/h3-9,11,13-14,18H,2,10,12,15-16H2,1H3,(H2,25,29)(H,26,30)(H,27,33)/b13-11+/t18-/m0/s1