ethyl 3-[[bis(phenylmethyl)amino]methyl]-6-(dimethylamino)-4-oxidanylidene-1H-quinoline-2-carboxylate

Systemtic Name: ethyl 3-[[bis(phenylmethyl)amino]methyl]-6-(dimethylamino)-4-oxidanylidene-1H-quinoline-2-carboxylate Openeye Name: ethyl 3-[(dibenzylamino)methyl]-6-(dimethylamino)-4-oxo-1H-quinoline-2-carboxylate CAS Name: 3-[[bis(phenylmethyl)amino]methyl]-6-(dimethylamino)-4-oxo-1H-quinoline-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[(dibenzylamino)methyl]-6-(dimethylamino)-4-oxo-1H-quinoline-2-carboxylate Traditional Name: 3-[(dibenzylamino)methyl]-6-(dimethylamino)-4-keto-1H-quinoline-2-carboxylic acid ethyl ester Formula: C29H31N3O3 MolecularWeight: 469.57474

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=O)C2=C(N1)C=CC(=C2)N(C)C)CN(CC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(C(=O)C2=C(N1)C=CC(=C2)N(C)C)CN(CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C29H31N3O3/c1-4-35-29(34)27-25(28(33)24-17-23(31(2)3)15-16-26(24)30-27)20-32(18-21-11-7-5-8-12-21)19-22-13-9-6-10-14-22/h5-17H,4,18-20H2,1-3H3,(H,30,33)