[1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl] 3-bromanyl-1H-indole-2-carboxylate

Systemtic Name: [1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl] 3-bromanyl-1H-indole-2-carboxylate Openeye Name: [1-methyl-2-oxo-2-(4-phenylpiperazin-1-yl)ethyl] 3-bromo-1H-indole-2-carboxylate CAS Name: 3-bromo-1H-indole-2-carboxylic acid [1-oxo-1-(4-phenyl-1-piperazinyl)propan-2-yl] ester IUPAC Name: [1-oxo-1-(4-phenylpiperazin-1-yl)propan-2-yl] 3-bromo-1H-indole-2-carboxylate Traditional Name: 3-bromo-1H-indole-2-carboxylic acid [2-keto-1-methyl-2-(4-phenylpiperazino)ethyl] ester Formula: C22H22BrN3O3 MolecularWeight: 456.33238

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=CC=CC=C2)OC(=O)C3=C(C4=CC=CC=C4N3)Br

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C2=CC=CC=C2)OC(=O)C3=C(C4=CC=CC=C4N3)Br

InChI

InChI=1S/C22H22BrN3O3/c1-15(29-22(28)20-19(23)17-9-5-6-10-18(17)24-20)21(27)26-13-11-25(12-14-26)16-7-3-2-4-8-16/h2-10,15,24H,11-14H2,1H3