ethyl 5-methoxy-2-methyl-1-[2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]indole-3-carboxylate

Systemtic Name: ethyl 5-methoxy-2-methyl-1-[2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]indole-3-carboxylate Openeye Name: ethyl 5-methoxy-2-methyl-1-[2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]indole-3-carboxylate CAS Name: 5-methoxy-2-methyl-1-[2-(4-methyl-1-piperazine-1,4-diiumyl)ethyl]-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methoxy-2-methyl-1-[2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]indole-3-carboxylate Traditional Name: 5-methoxy-2-methyl-1-[2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]indole-3-carboxylic acid ethyl ester Formula: C20H31N3O3+2 MolecularWeight: 361.47844

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OC)CC[NH+]3CC[NH+](CC3)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OC)CC[NH+]3CC[NH+](CC3)C)C

InChI

InChI=1S/C20H29N3O3/c1-5-26-20(24)19-15(2)23(13-12-22-10-8-21(3)9-11-22)18-7-6-16(25-4)14-17(18)19/h6-7,14H,5,8-13H2,1-4H3/p+2