(6,7-dimethoxy-4-morpholin-4-yl-quinolin-1-ium-3-yl)-(4-ethylphenyl)methanone

Systemtic Name: (6,7-dimethoxy-4-morpholin-4-yl-quinolin-1-ium-3-yl)-(4-ethylphenyl)methanone Openeye Name: (6,7-dimethoxy-4-morpholino-quinolin-1-ium-3-yl)-(4-ethylphenyl)methanone CAS Name: [6,7-dimethoxy-4-(4-morpholinyl)-3-quinolin-1-iumyl]-(4-ethylphenyl)methanone IUPAC Name: (6,7-dimethoxy-4-morpholin-4-ylquinolin-1-ium-3-yl)-(4-ethylphenyl)methanone Traditional Name: (6,7-dimethoxy-4-morpholino-quinolin-1-ium-3-yl)-(4-ethylphenyl)methanone Formula: C24H27N2O4+ MolecularWeight: 407.48218

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)C2=C(C3=CC(=C(C=C3[NH+]=C2)OC)OC)N4CCOCC4

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)C2=C(C3=CC(=C(C=C3[NH+]=C2)OC)OC)N4CCOCC4

InChI

InChI=1S/C24H26N2O4/c1-4-16-5-7-17(8-6-16)24(27)19-15-25-20-14-22(29-3)21(28-2)13-18(20)23(19)26-9-11-30-12-10-26/h5-8,13-15H,4,9-12H2,1-3H3/p+1