[2-[[4-(azepan-1-yl)phenyl]amino]-2-oxidanylidene-ethyl] quinoline-8-carboxylate

Systemtic Name: [2-[[4-(azepan-1-yl)phenyl]amino]-2-oxidanylidene-ethyl] quinoline-8-carboxylate Openeye Name: [2-[4-(azepan-1-yl)anilino]-2-oxo-ethyl] quinoline-8-carboxylate CAS Name: 8-quinolinecarboxylic acid [2-[4-(1-azepanyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-[4-(azepan-1-yl)anilino]-2-oxoethyl] quinoline-8-carboxylate Traditional Name: quinoline-8-carboxylic acid [2-[4-(azepan-1-yl)anilino]-2-keto-ethyl] ester Formula: C24H25N3O3 MolecularWeight: 403.4736

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=C(C=C2)NC(=O)COC(=O)C3=CC=CC4=C3N=CC=C4

Isomeric SMILES

C1CCCN(CC1)C2=CC=C(C=C2)NC(=O)COC(=O)C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C24H25N3O3/c28-22(17-30-24(29)21-9-5-7-18-8-6-14-25-23(18)21)26-19-10-12-20(13-11-19)27-15-3-1-2-4-16-27/h5-14H,1-4,15-17H2,(H,26,28)