ethyl 5,6-dimethoxy-3-[2-[(3S)-4-(4-methoxyphenyl)-3-methyl-piperazin-1-yl]ethanoylamino]-1H-indole-2-carboxylate

Systemtic Name: ethyl 5,6-dimethoxy-3-[2-[(3S)-4-(4-methoxyphenyl)-3-methyl-piperazin-1-yl]ethanoylamino]-1H-indole-2-carboxylate Openeye Name: ethyl 5,6-dimethoxy-3-[[2-[(3S)-4-(4-methoxyphenyl)-3-methyl-piperazin-1-yl]acetyl]amino]-1H-indole-2-carboxylate CAS Name: 5,6-dimethoxy-3-[[2-[(3S)-4-(4-methoxyphenyl)-3-methyl-1-piperazinyl]-1-oxoethyl]amino]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5,6-dimethoxy-3-[[2-[(3S)-4-(4-methoxyphenyl)-3-methylpiperazin-1-yl]acetyl]amino]-1H-indole-2-carboxylate Traditional Name: 5,6-dimethoxy-3-[[2-[(3S)-4-(4-methoxyphenyl)-3-methyl-piperazino]acetyl]amino]-1H-indole-2-carboxylic acid ethyl ester Formula: C27H34N4O6 MolecularWeight: 510.58206

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC(=C(C=C2N1)OC)OC)NC(=O)CN3CCN(C(C3)C)C4=CC=C(C=C4)OC

Isomeric SMILES

CCOC(=O)C1=C(C2=CC(=C(C=C2N1)OC)OC)NC(=O)CN3CCN([C@H](C3)C)C4=CC=C(C=C4)OC

InChI

InChI=1S/C27H34N4O6/c1-6-37-27(33)26-25(20-13-22(35-4)23(36-5)14-21(20)28-26)29-24(32)16-30-11-12-31(17(2)15-30)18-7-9-19(34-3)10-8-18/h7-10,13-14,17,28H,6,11-12,15-16H2,1-5H3,(H,29,32)/t17-/m0/s1