N-[(1S,2S,3S)-2,3-dimethylcyclohexyl]-5,8-dimethoxy-4-methyl-quinolin-1-ium-2-amine

Systemtic Name: N-[(1S,2S,3S)-2,3-dimethylcyclohexyl]-5,8-dimethoxy-4-methyl-quinolin-1-ium-2-amine Openeye Name: N-[(1S,2S,3S)-2,3-dimethylcyclohexyl]-5,8-dimethoxy-4-methyl-quinolin-1-ium-2-amine CAS Name: N-[(1S,2S,3S)-2,3-dimethylcyclohexyl]-5,8-dimethoxy-4-methyl-2-quinolin-1-iumamine IUPAC Name: N-[(1S,2S,3S)-2,3-dimethylcyclohexyl]-5,8-dimethoxy-4-methylquinolin-1-ium-2-amine Traditional Name: (5,8-dimethoxy-4-methyl-quinolin-1-ium-2-yl)-[(1S,2S,3S)-2,3-dimethylcyclohexyl]amine Formula: C20H29N2O2+ MolecularWeight: 329.45646

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC2=[NH+]C3=C(C=CC(=C3C(=C2)C)OC)OC

Isomeric SMILES

C[C@H]1CCC[C@@H]([C@H]1C)NC2=[NH+]C3=C(C=CC(=C3C(=C2)C)OC)OC

InChI

InChI=1S/C20H28N2O2/c1-12-7-6-8-15(14(12)3)21-18-11-13(2)19-16(23-4)9-10-17(24-5)20(19)22-18/h9-12,14-15H,6-8H2,1-5H3,(H,21,22)/p+1/t12-,14-,15-/m0/s1