ethyl 2-oxidanylidene-7-(phenylmethyl)-5,6,8,9-tetrahydro-1H-pyrido[2,3-d]azepine-3-carboxylate

Systemtic Name: ethyl 2-oxidanylidene-7-(phenylmethyl)-5,6,8,9-tetrahydro-1H-pyrido[2,3-d]azepine-3-carboxylate Openeye Name: ethyl 7-benzyl-2-oxo-5,6,8,9-tetrahydro-1H-pyrido[2,3-d]azepine-3-carboxylate CAS Name: 2-oxo-7-(phenylmethyl)-5,6,8,9-tetrahydro-1H-pyrido[2,3-d]azepine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 7-benzyl-2-oxo-5,6,8,9-tetrahydro-1H-pyrido[2,3-d]azepine-3-carboxylate Traditional Name: 7-benzyl-2-keto-5,6,8,9-tetrahydro-1H-pyrid[2,3-d]azepine-3-carboxylic acid ethyl ester Formula: C19H22N2O3 MolecularWeight: 326.38958

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(CCN(CC2)CC3=CC=CC=C3)NC1=O

Isomeric SMILES

CCOC(=O)C1=CC2=C(CCN(CC2)CC3=CC=CC=C3)NC1=O

InChI

InChI=1S/C19H22N2O3/c1-2-24-19(23)16-12-15-8-10-21(11-9-17(15)20-18(16)22)13-14-6-4-3-5-7-14/h3-7,12H,2,8-11,13H2,1H3,(H,20,22)