ethyl 4-[(diphenylmethyl)amino]-6-methoxy-quinolin-1-ium-3-carboxylate

Systemtic Name: ethyl 4-[(diphenylmethyl)amino]-6-methoxy-quinolin-1-ium-3-carboxylate Openeye Name: ethyl 4-(benzhydrylamino)-6-methoxy-quinolin-1-ium-3-carboxylate CAS Name: 4-[(diphenylmethyl)amino]-6-methoxy-3-quinolin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 4-(benzhydrylamino)-6-methoxyquinolin-1-ium-3-carboxylate Traditional Name: 4-(benzhydrylamino)-6-methoxy-quinolin-1-ium-3-carboxylic acid ethyl ester Formula: C26H25N2O3+ MolecularWeight: 413.4883

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C[NH+]=C2C=CC(=CC2=C1NC(C3=CC=CC=C3)C4=CC=CC=C4)OC

Isomeric SMILES

CCOC(=O)C1=C[NH+]=C2C=CC(=CC2=C1NC(C3=CC=CC=C3)C4=CC=CC=C4)OC

InChI

InChI=1S/C26H24N2O3/c1-3-31-26(29)22-17-27-23-15-14-20(30-2)16-21(23)25(22)28-24(18-10-6-4-7-11-18)19-12-8-5-9-13-19/h4-17,24H,3H2,1-2H3,(H,27,28)/p+1