(E)-N-cyclopropyl-N-[[2-(dimethylamino)-7-methyl-quinolin-1-ium-3-yl]methyl]-3-(4-methoxyphenyl)prop-2-enamide

Systemtic Name: (E)-N-cyclopropyl-N-[[2-(dimethylamino)-7-methyl-quinolin-1-ium-3-yl]methyl]-3-(4-methoxyphenyl)prop-2-enamide Openeye Name: (E)-N-cyclopropyl-N-[[2-(dimethylamino)-7-methyl-quinolin-1-ium-3-yl]methyl]-3-(4-methoxyphenyl)prop-2-enamide CAS Name: (E)-N-cyclopropyl-N-[[2-(dimethylamino)-7-methyl-3-quinolin-1-iumyl]methyl]-3-(4-methoxyphenyl)-2-propenamide IUPAC Name: (E)-N-cyclopropyl-N-[[2-(dimethylamino)-7-methylquinolin-1-ium-3-yl]methyl]-3-(4-methoxyphenyl)prop-2-enamide Traditional Name: (E)-N-cyclopropyl-N-[[2-(dimethylamino)-7-methyl-quinolin-1-ium-3-yl]methyl]-3-(4-methoxyphenyl)acrylamide Formula: C26H30N3O2+ MolecularWeight: 416.5353

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=[NH+]C(=C(C=C2C=C1)CN(C3CC3)C(=O)C=CC4=CC=C(C=C4)OC)N(C)C

Isomeric SMILES

CC1=CC2=[NH+]C(=C(C=C2C=C1)CN(C3CC3)C(=O)/C=C/C4=CC=C(C=C4)OC)N(C)C

InChI

InChI=1S/C26H29N3O2/c1-18-5-9-20-16-21(26(28(2)3)27-24(20)15-18)17-29(22-10-11-22)25(30)14-8-19-6-12-23(31-4)13-7-19/h5-9,12-16,22H,10-11,17H2,1-4H3/p+1/b14-8+