propyl 4-[(6-ethoxy-2-methyl-quinolin-1-ium-4-yl)amino]benzoate

Systemtic Name: propyl 4-[(6-ethoxy-2-methyl-quinolin-1-ium-4-yl)amino]benzoate Openeye Name: propyl 4-[(6-ethoxy-2-methyl-quinolin-1-ium-4-yl)amino]benzoate CAS Name: 4-[(6-ethoxy-2-methyl-4-quinolin-1-iumyl)amino]benzoic acid propyl ester IUPAC Name: propyl 4-[(6-ethoxy-2-methylquinolin-1-ium-4-yl)amino]benzoate Traditional Name: 4-[(6-ethoxy-2-methyl-quinolin-1-ium-4-yl)amino]benzoic acid propyl ester Formula: C22H25N2O3+ MolecularWeight: 365.4455

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC2=CC(=[NH+]C3=C2C=C(C=C3)OCC)C

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC2=CC(=[NH+]C3=C2C=C(C=C3)OCC)C

InChI

InChI=1S/C22H24N2O3/c1-4-12-27-22(25)16-6-8-17(9-7-16)24-21-13-15(3)23-20-11-10-18(26-5-2)14-19(20)21/h6-11,13-14H,4-5,12H2,1-3H3,(H,23,24)/p+1