N,N-dimethyl-4-[(S)-(2-methyl-1H-indol-3-yl)-(4-methylpiperazine-1,4-diium-1-yl)methyl]aniline

Systemtic Name: N,N-dimethyl-4-[(S)-(2-methyl-1H-indol-3-yl)-(4-methylpiperazine-1,4-diium-1-yl)methyl]aniline Openeye Name: N,N-dimethyl-4-[(S)-(2-methyl-1H-indol-3-yl)-(4-methylpiperazine-1,4-diium-1-yl)methyl]aniline CAS Name: N,N-dimethyl-4-[(S)-(2-methyl-1H-indol-3-yl)-(4-methyl-1-piperazine-1,4-diiumyl)methyl]aniline IUPAC Name: N,N-dimethyl-4-[(S)-(2-methyl-1H-indol-3-yl)-(4-methylpiperazine-1,4-diium-1-yl)methyl]aniline Traditional Name: dimethyl-[4-[(S)-(2-methyl-1H-indol-3-yl)-(4-methylpiperazine-1,4-diium-1-yl)methyl]phenyl]amine Formula: C23H32N4+2 MolecularWeight: 364.52698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(C3=CC=C(C=C3)N(C)C)[NH+]4CC[NH+](CC4)C

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)[C@H](C3=CC=C(C=C3)N(C)C)[NH+]4CC[NH+](CC4)C

InChI

InChI=1S/C23H30N4/c1-17-22(20-7-5-6-8-21(20)24-17)23(27-15-13-26(4)14-16-27)18-9-11-19(12-10-18)25(2)3/h5-12,23-24H,13-16H2,1-4H3/p+2/t23-/m0/s1