ethyl 3-[[5-oxidanylidene-1-[3-(pyridin-3-ylcarbonylamino)phenyl]pyrrolidin-3-yl]carbonylamino]-3-pyridin-3-yl-propanoate

Systemtic Name: ethyl 3-[[5-oxidanylidene-1-[3-(pyridin-3-ylcarbonylamino)phenyl]pyrrolidin-3-yl]carbonylamino]-3-pyridin-3-yl-propanoate Openeye Name: ethyl 3-[[5-oxo-1-[3-(pyridine-3-carbonylamino)phenyl]pyrrolidine-3-carbonyl]amino]-3-(3-pyridyl)propanoate CAS Name: 3-[[oxo-[5-oxo-1-[3-[[oxo(3-pyridinyl)methyl]amino]phenyl]-3-pyrrolidinyl]methyl]amino]-3-(3-pyridinyl)propanoic acid ethyl ester IUPAC Name: ethyl 3-[[5-oxo-1-[3-(pyridine-3-carbonylamino)phenyl]pyrrolidine-3-carbonyl]amino]-3-pyridin-3-ylpropanoate Traditional Name: 3-[[5-keto-1-(3-nicotinamidophenyl)pyrrolidine-3-carbonyl]amino]-3-(3-pyridyl)propionic acid ethyl ester Formula: C27H27N5O5 MolecularWeight: 501.53378

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=CN=CC=C1)NC(=O)C2CC(=O)N(C2)C3=CC(=CC=C3)NC(=O)C4=CN=CC=C4

Isomeric SMILES

CCOC(=O)CC(C1=CN=CC=C1)NC(=O)C2CC(=O)N(C2)C3=CC(=CC=C3)NC(=O)C4=CN=CC=C4

InChI

InChI=1S/C27H27N5O5/c1-2-37-25(34)14-23(18-6-4-10-28-15-18)31-27(36)20-12-24(33)32(17-20)22-9-3-8-21(13-22)30-26(35)19-7-5-11-29-16-19/h3-11,13,15-16,20,23H,2,12,14,17H2,1H3,(H,30,35)(H,31,36)