methyl 3-[2-[4-(2,5-dimethylphenyl)piperazin-1-yl]ethanoylamino]-5-methyl-1H-indole-2-carboxylate

Systemtic Name: methyl 3-[2-[4-(2,5-dimethylphenyl)piperazin-1-yl]ethanoylamino]-5-methyl-1H-indole-2-carboxylate Openeye Name: methyl 3-[[2-[4-(2,5-dimethylphenyl)piperazin-1-yl]acetyl]amino]-5-methyl-1H-indole-2-carboxylate CAS Name: 3-[[2-[4-(2,5-dimethylphenyl)-1-piperazinyl]-1-oxoethyl]amino]-5-methyl-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[[2-[4-(2,5-dimethylphenyl)piperazin-1-yl]acetyl]amino]-5-methyl-1H-indole-2-carboxylate Traditional Name: 3-[[2-[4-(2,5-dimethylphenyl)piperazino]acetyl]amino]-5-methyl-1H-indole-2-carboxylic acid methyl ester Formula: C25H30N4O3 MolecularWeight: 434.5307

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C2NC(=O)CN3CCN(CC3)C4=C(C=CC(=C4)C)C)C(=O)OC

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C2NC(=O)CN3CCN(CC3)C4=C(C=CC(=C4)C)C)C(=O)OC

InChI

InChI=1S/C25H30N4O3/c1-16-6-8-20-19(13-16)23(24(26-20)25(31)32-4)27-22(30)15-28-9-11-29(12-10-28)21-14-17(2)5-7-18(21)3/h5-8,13-14,26H,9-12,15H2,1-4H3,(H,27,30)