methyl 3-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propanoylamino]-5-methyl-1H-indole-2-carboxylate

Systemtic Name: methyl 3-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propanoylamino]-5-methyl-1H-indole-2-carboxylate Openeye Name: methyl 3-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propanoylamino]-5-methyl-1H-indole-2-carboxylate CAS Name: 3-[[3-[4-(2-methoxyphenyl)-1-piperazinyl]-1-oxopropyl]amino]-5-methyl-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propanoylamino]-5-methyl-1H-indole-2-carboxylate Traditional Name: 3-[3-[4-(2-methoxyphenyl)piperazino]propanoylamino]-5-methyl-1H-indole-2-carboxylic acid methyl ester Formula: C25H30N4O4 MolecularWeight: 450.5301

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C2NC(=O)CCN3CCN(CC3)C4=CC=CC=C4OC)C(=O)OC

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C2NC(=O)CCN3CCN(CC3)C4=CC=CC=C4OC)C(=O)OC

InChI

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