ethyl 4-[(5-bromanyl-1-ethanoyl-2,3-dihydroindol-7-yl)sulfonyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(5-bromanyl-1-ethanoyl-2,3-dihydroindol-7-yl)sulfonyl]piperazine-1-carboxylate Openeye Name: ethyl 4-(1-acetyl-5-bromo-indolin-7-yl)sulfonylpiperazine-1-carboxylate CAS Name: 4-[(1-acetyl-5-bromo-2,3-dihydroindol-7-yl)sulfonyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(1-acetyl-5-bromo-2,3-dihydroindol-7-yl)sulfonyl]piperazine-1-carboxylate Traditional Name: 4-(1-acetyl-5-bromo-indolin-7-yl)sulfonylpiperazine-1-carboxylic acid ethyl ester Formula: C17H22BrN3O5S MolecularWeight: 460.34268

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=C3C(=CC(=C2)Br)CCN3C(=O)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=C3C(=CC(=C2)Br)CCN3C(=O)C

InChI

InChI=1S/C17H22BrN3O5S/c1-3-26-17(23)19-6-8-20(9-7-19)27(24,25)15-11-14(18)10-13-4-5-21(12(2)22)16(13)15/h10-11H,3-9H2,1-2H3