methyl 5-bromanyl-3-[2-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]ethanoylamino]-1H-indole-2-carboxylate

Systemtic Name: methyl 5-bromanyl-3-[2-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]ethanoylamino]-1H-indole-2-carboxylate Openeye Name: methyl 5-bromo-3-[[2-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]acetyl]amino]-1H-indole-2-carboxylate CAS Name: 5-bromo-3-[[2-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-1-oxoethyl]amino]-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 5-bromo-3-[[2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]acetyl]amino]-1H-indole-2-carboxylate Traditional Name: 5-bromo-3-[[2-[4-(5-chloro-2-methyl-phenyl)piperazino]acetyl]amino]-1H-indole-2-carboxylic acid methyl ester Formula: C23H24BrClN4O3 MolecularWeight: 519.81866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)CC(=O)NC3=C(NC4=C3C=C(C=C4)Br)C(=O)OC

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)CC(=O)NC3=C(NC4=C3C=C(C=C4)Br)C(=O)OC

InChI

InChI=1S/C23H24BrClN4O3/c1-14-3-5-16(25)12-19(14)29-9-7-28(8-10-29)13-20(30)27-21-17-11-15(24)4-6-18(17)26-22(21)23(31)32-2/h3-6,11-12,26H,7-10,13H2,1-2H3,(H,27,30)