ethyl 2-(1,2-diazepin-1-yl)-6-(2-ethoxy-2-oxidanylidene-ethyl)benzoate

Systemtic Name: ethyl 2-(1,2-diazepin-1-yl)-6-(2-ethoxy-2-oxidanylidene-ethyl)benzoate Openeye Name: ethyl 2-(diazepin-1-yl)-6-(2-ethoxy-2-oxo-ethyl)benzoate CAS Name: 2-(1-diazepinyl)-6-(2-ethoxy-2-oxoethyl)benzoic acid ethyl ester IUPAC Name: ethyl 2-(diazepin-1-yl)-6-(2-ethoxy-2-oxoethyl)benzoate Traditional Name: 2-(diazepin-1-yl)-6-(2-ethoxy-2-keto-ethyl)benzoic acid ethyl ester Formula: C18H20N2O4 MolecularWeight: 328.3624

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(C(=CC=C1)N2C=CC=CC=N2)C(=O)OCC

Isomeric SMILES

CCOC(=O)CC1=C(C(=CC=C1)N2C=CC=CC=N2)C(=O)OCC

InChI

InChI=1S/C18H20N2O4/c1-3-23-16(21)13-14-9-8-10-15(17(14)18(22)24-4-2)20-12-7-5-6-11-19-20/h5-12H,3-4,13H2,1-2H3