ethyl (E)-7-azanyl-4-[[2-[(5-naphthalen-1-yl-1H-pyrrol-2-yl)carbonylamino]-3-phenyl-propanoyl]amino]-7-oxidanylidene-hept-2-enoate

Systemtic Name: ethyl (E)-7-azanyl-4-[[2-[(5-naphthalen-1-yl-1H-pyrrol-2-yl)carbonylamino]-3-phenyl-propanoyl]amino]-7-oxidanylidene-hept-2-enoate Openeye Name: ethyl (E)-7-amino-4-[[2-[[5-(1-naphthyl)-1H-pyrrole-2-carbonyl]amino]-3-phenyl-propanoyl]amino]-7-oxo-hept-2-enoate CAS Name: (E)-7-amino-4-[[2-[[[5-(1-naphthalenyl)-1H-pyrrol-2-yl]-oxomethyl]amino]-1-oxo-3-phenylpropyl]amino]-7-oxo-2-heptenoic acid ethyl ester IUPAC Name: ethyl (E)-7-amino-4-[[2-[(5-naphthalen-1-yl-1H-pyrrole-2-carbonyl)amino]-3-phenylpropanoyl]amino]-7-oxohept-2-enoate Traditional Name: (E)-7-amino-7-keto-4-[[2-[[5-(1-naphthyl)-1H-pyrrole-2-carbonyl]amino]-3-phenyl-propanoyl]amino]hept-2-enoic acid ethyl ester Formula: C33H34N4O5 MolecularWeight: 566.64686

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(CCC(=O)N)NC(=O)C(CC1=CC=CC=C1)NC(=O)C2=CC=C(N2)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCOC(=O)/C=C/C(CCC(=O)N)NC(=O)C(CC1=CC=CC=C1)NC(=O)C2=CC=C(N2)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C33H34N4O5/c1-2-42-31(39)20-16-24(15-19-30(34)38)35-33(41)29(21-22-9-4-3-5-10-22)37-32(40)28-18-17-27(36-28)26-14-8-12-23-11-6-7-13-25(23)26/h3-14,16-18,20,24,29,36H,2,15,19,21H2,1H3,(H2,34,38)(H,35,41)(H,37,40)/b20-16+