ethyl 3-[[2-(azepan-1-ylcarbonyl)phenyl]amino]-3-oxidanylidene-propanoate

Systemtic Name: ethyl 3-[[2-(azepan-1-ylcarbonyl)phenyl]amino]-3-oxidanylidene-propanoate Openeye Name: ethyl 3-[2-(azepane-1-carbonyl)anilino]-3-oxo-propanoate CAS Name: 3-[2-[1-azepanyl(oxo)methyl]anilino]-3-oxopropanoic acid ethyl ester IUPAC Name: ethyl 3-[2-(azepane-1-carbonyl)anilino]-3-oxopropanoate Traditional Name: 3-[2-(azepane-1-carbonyl)anilino]-3-keto-propionic acid ethyl ester Formula: C18H24N2O4 MolecularWeight: 332.39416

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)NC1=CC=CC=C1C(=O)N2CCCCCC2

Isomeric SMILES

CCOC(=O)CC(=O)NC1=CC=CC=C1C(=O)N2CCCCCC2

InChI

InChI=1S/C18H24N2O4/c1-2-24-17(22)13-16(21)19-15-10-6-5-9-14(15)18(23)20-11-7-3-4-8-12-20/h5-6,9-10H,2-4,7-8,11-13H2,1H3,(H,19,21)