[2-[ethyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl] 6-chloranyl-2-methyl-quinoline-3-carboxylate

Systemtic Name: [2-[ethyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl] 6-chloranyl-2-methyl-quinoline-3-carboxylate Openeye Name: [2-[benzyl(ethyl)amino]-2-oxo-ethyl] 6-chloro-2-methyl-quinoline-3-carboxylate CAS Name: 6-chloro-2-methyl-3-quinolinecarboxylic acid [2-[ethyl-(phenylmethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[benzyl(ethyl)amino]-2-oxoethyl] 6-chloro-2-methylquinoline-3-carboxylate Traditional Name: 6-chloro-2-methyl-quinoline-3-carboxylic acid [2-[benzyl(ethyl)amino]-2-keto-ethyl] ester Formula: C22H21ClN2O3 MolecularWeight: 396.86674

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C(=O)COC(=O)C2=C(N=C3C=CC(=CC3=C2)Cl)C

Isomeric SMILES

CCN(CC1=CC=CC=C1)C(=O)COC(=O)C2=C(N=C3C=CC(=CC3=C2)Cl)C

InChI

InChI=1S/C22H21ClN2O3/c1-3-25(13-16-7-5-4-6-8-16)21(26)14-28-22(27)19-12-17-11-18(23)9-10-20(17)24-15(19)2/h4-12H,3,13-14H2,1-2H3