methyl 3-[3-[4-(4-chlorophenyl)piperazin-1-yl]propanoylamino]-6-methoxy-1H-indole-2-carboxylate

Systemtic Name: methyl 3-[3-[4-(4-chlorophenyl)piperazin-1-yl]propanoylamino]-6-methoxy-1H-indole-2-carboxylate Openeye Name: methyl 3-[3-[4-(4-chlorophenyl)piperazin-1-yl]propanoylamino]-6-methoxy-1H-indole-2-carboxylate CAS Name: 3-[[3-[4-(4-chlorophenyl)-1-piperazinyl]-1-oxopropyl]amino]-6-methoxy-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[3-[4-(4-chlorophenyl)piperazin-1-yl]propanoylamino]-6-methoxy-1H-indole-2-carboxylate Traditional Name: 3-[3-[4-(4-chlorophenyl)piperazino]propanoylamino]-6-methoxy-1H-indole-2-carboxylic acid methyl ester Formula: C24H27ClN4O4 MolecularWeight: 470.94858

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=C(N2)C(=O)OC)NC(=O)CCN3CCN(CC3)C4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)C(=C(N2)C(=O)OC)NC(=O)CCN3CCN(CC3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H27ClN4O4/c1-32-18-7-8-19-20(15-18)26-23(24(31)33-2)22(19)27-21(30)9-10-28-11-13-29(14-12-28)17-5-3-16(25)4-6-17/h3-8,15,26H,9-14H2,1-2H3,(H,27,30)