[2-(azepan-1-yl)-2-oxidanylidene-ethyl] 2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylate

Systemtic Name: [2-(azepan-1-yl)-2-oxidanylidene-ethyl] 2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylate Openeye Name: [2-(azepan-1-yl)-2-oxo-ethyl] 2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylate CAS Name: 2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylic acid [2-(1-azepanyl)-2-oxoethyl] ester IUPAC Name: [2-(azepan-1-yl)-2-oxoethyl] 2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylate Traditional Name: 2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylic acid [2-(azepan-1-yl)-2-keto-ethyl] ester Formula: C22H27N3O3 MolecularWeight: 381.46808

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)OCC(=O)N4CCCCCC4

Isomeric SMILES

CN1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)OCC(=O)N4CCCCCC4

InChI

InChI=1S/C22H27N3O3/c1-24-13-10-19-17(14-24)21(16-8-4-5-9-18(16)23-19)22(27)28-15-20(26)25-11-6-2-3-7-12-25/h4-5,8-9H,2-3,6-7,10-15H2,1H3