4,6-dimethoxy-1-methyl-N-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethyl]indole-2-carboxamide

Systemtic Name: 4,6-dimethoxy-1-methyl-N-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethyl]indole-2-carboxamide Openeye Name: N-[2-(4-benzylpiperazin-4-ium-1-yl)-2-oxo-ethyl]-4,6-dimethoxy-1-methyl-indole-2-carboxamide CAS Name: 4,6-dimethoxy-1-methyl-N-[2-oxo-2-[4-(phenylmethyl)-1-piperazin-4-iumyl]ethyl]-2-indolecarboxamide IUPAC Name: N-[2-(4-benzylpiperazin-4-ium-1-yl)-2-oxoethyl]-4,6-dimethoxy-1-methylindole-2-carboxamide Traditional Name: N-[2-(4-benzylpiperazin-4-ium-1-yl)-2-keto-ethyl]-4,6-dimethoxy-1-methyl-indole-2-carboxamide Formula: C25H31N4O4+ MolecularWeight: 451.53804

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC(=CC(=C2C=C1C(=O)NCC(=O)N3CC[NH+](CC3)CC4=CC=CC=C4)OC)OC

Isomeric SMILES

CN1C2=CC(=CC(=C2C=C1C(=O)NCC(=O)N3CC[NH+](CC3)CC4=CC=CC=C4)OC)OC

InChI

InChI=1S/C25H30N4O4/c1-27-21-13-19(32-2)14-23(33-3)20(21)15-22(27)25(31)26-16-24(30)29-11-9-28(10-12-29)17-18-7-5-4-6-8-18/h4-8,13-15H,9-12,16-17H2,1-3H3,(H,26,31)/p+1