ethyl 3-[2-[4-(3,4-dichlorophenyl)piperazin-1-ium-1-yl]ethanoylamino]-5-methoxy-1H-indole-2-carboxylate

Systemtic Name: ethyl 3-[2-[4-(3,4-dichlorophenyl)piperazin-1-ium-1-yl]ethanoylamino]-5-methoxy-1H-indole-2-carboxylate Openeye Name: ethyl 3-[[2-[4-(3,4-dichlorophenyl)piperazin-1-ium-1-yl]acetyl]amino]-5-methoxy-1H-indole-2-carboxylate CAS Name: 3-[[2-[4-(3,4-dichlorophenyl)-1-piperazin-1-iumyl]-1-oxoethyl]amino]-5-methoxy-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-[4-(3,4-dichlorophenyl)piperazin-1-ium-1-yl]acetyl]amino]-5-methoxy-1H-indole-2-carboxylate Traditional Name: 3-[[2-[4-(3,4-dichlorophenyl)piperazin-1-ium-1-yl]acetyl]amino]-5-methoxy-1H-indole-2-carboxylic acid ethyl ester Formula: C24H27Cl2N4O4+ MolecularWeight: 506.40158

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)OC)NC(=O)C[NH+]3CCN(CC3)C4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)OC)NC(=O)C[NH+]3CCN(CC3)C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C24H26Cl2N4O4/c1-3-34-24(32)23-22(17-13-16(33-2)5-7-20(17)27-23)28-21(31)14-29-8-10-30(11-9-29)15-4-6-18(25)19(26)12-15/h4-7,12-13,27H,3,8-11,14H2,1-2H3,(H,28,31)/p+1