methyl 2-[4-[(6-bromanyl-1H-indol-2-yl)carbonyl]piperazin-1-yl]-2-(2-chlorophenyl)ethanoate

Systemtic Name: methyl 2-[4-[(6-bromanyl-1H-indol-2-yl)carbonyl]piperazin-1-yl]-2-(2-chlorophenyl)ethanoate Openeye Name: methyl 2-[4-(6-bromo-1H-indole-2-carbonyl)piperazin-1-yl]-2-(2-chlorophenyl)acetate CAS Name: 2-[4-[(6-bromo-1H-indol-2-yl)-oxomethyl]-1-piperazinyl]-2-(2-chlorophenyl)acetic acid methyl ester IUPAC Name: methyl 2-[4-(6-bromo-1H-indole-2-carbonyl)piperazin-1-yl]-2-(2-chlorophenyl)acetate Traditional Name: 2-[4-(6-bromo-1H-indole-2-carbonyl)piperazino]-2-(2-chlorophenyl)acetic acid methyl ester Formula: C22H21BrClN3O3 MolecularWeight: 490.77744

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1Cl)N2CCN(CC2)C(=O)C3=CC4=C(N3)C=C(C=C4)Br

Isomeric SMILES

COC(=O)C(C1=CC=CC=C1Cl)N2CCN(CC2)C(=O)C3=CC4=C(N3)C=C(C=C4)Br

InChI

InChI=1S/C22H21BrClN3O3/c1-30-22(29)20(16-4-2-3-5-17(16)24)26-8-10-27(11-9-26)21(28)19-12-14-6-7-15(23)13-18(14)25-19/h2-7,12-13,20,25H,8-11H2,1H3