[2-(azepan-1-yl)-2-oxidanylidene-ethyl] naphthalene-2-carboxylate

Systemtic Name: [2-(azepan-1-yl)-2-oxidanylidene-ethyl] naphthalene-2-carboxylate Openeye Name: [2-(azepan-1-yl)-2-oxo-ethyl] naphthalene-2-carboxylate CAS Name: 2-naphthalenecarboxylic acid [2-(1-azepanyl)-2-oxoethyl] ester IUPAC Name: [2-(azepan-1-yl)-2-oxoethyl] naphthalene-2-carboxylate Traditional Name: naphthalene-2-carboxylic acid [2-(azepan-1-yl)-2-keto-ethyl] ester Formula: C19H21NO3 MolecularWeight: 311.37494

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)COC(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

C1CCCN(CC1)C(=O)COC(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C19H21NO3/c21-18(20-11-5-1-2-6-12-20)14-23-19(22)17-10-9-15-7-3-4-8-16(15)13-17/h3-4,7-10,13H,1-2,5-6,11-12,14H2