(6-methyl-2-oxidanylidene-1-prop-2-enyl-quinolin-3-yl)methyl-(4-oxidanylcyclohexyl)azanium

Systemtic Name: (6-methyl-2-oxidanylidene-1-prop-2-enyl-quinolin-3-yl)methyl-(4-oxidanylcyclohexyl)azanium Openeye Name: (1-allyl-6-methyl-2-oxo-3-quinolyl)methyl-(4-hydroxycyclohexyl)ammonium CAS Name: (4-hydroxycyclohexyl)-[(6-methyl-2-oxo-1-prop-2-enyl-3-quinolinyl)methyl]ammonium IUPAC Name: (4-hydroxycyclohexyl)-[(6-methyl-2-oxo-1-prop-2-enylquinolin-3-yl)methyl]azanium Traditional Name: (1-allyl-2-keto-6-methyl-3-quinolyl)methyl-(4-hydroxycyclohexyl)ammonium Formula: C20H27N2O2+ MolecularWeight: 327.44058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)C(=C2)C[NH2+]C3CCC(CC3)O)CC=C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)C(=C2)C[NH2+]C3CCC(CC3)O)CC=C

InChI

InChI=1S/C20H26N2O2/c1-3-10-22-19-9-4-14(2)11-15(19)12-16(20(22)24)13-21-17-5-7-18(23)8-6-17/h3-4,9,11-12,17-18,21,23H,1,5-8,10,13H2,2H3/p+1