3-[(S)-(4-methoxyphenyl)-(4-methylpiperidin-1-ium-1-yl)methyl]-2-methyl-1H-indole

Systemtic Name: 3-[(S)-(4-methoxyphenyl)-(4-methylpiperidin-1-ium-1-yl)methyl]-2-methyl-1H-indole Openeye Name: 3-[(S)-(4-methoxyphenyl)-(4-methylpiperidin-1-ium-1-yl)methyl]-2-methyl-1H-indole CAS Name: 3-[(S)-(4-methoxyphenyl)-(4-methyl-1-piperidin-1-iumyl)methyl]-2-methyl-1H-indole IUPAC Name: 3-[(S)-(4-methoxyphenyl)-(4-methylpiperidin-1-ium-1-yl)methyl]-2-methyl-1H-indole Traditional Name: 3-[(S)-(4-methoxyphenyl)-(4-methylpiperidin-1-ium-1-yl)methyl]-2-methyl-1H-indole Formula: C23H29N2O+ MolecularWeight: 349.48916

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)C(C2=CC=C(C=C2)OC)C3=C(NC4=CC=CC=C43)C

Isomeric SMILES

CC1CC[NH+](CC1)[C@@H](C2=CC=C(C=C2)OC)C3=C(NC4=CC=CC=C43)C

InChI

InChI=1S/C23H28N2O/c1-16-12-14-25(15-13-16)23(18-8-10-19(26-3)11-9-18)22-17(2)24-21-7-5-4-6-20(21)22/h4-11,16,23-24H,12-15H2,1-3H3/p+1/t23-/m0/s1