2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-N-(3-nitrophenyl)propanamide

Systemtic Name: 2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-N-(3-nitrophenyl)propanamide Openeye Name: 2-(4-indan-5-ylsulfonylpiperazin-1-yl)-N-(3-nitrophenyl)propanamide CAS Name: 2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1-piperazinyl]-N-(3-nitrophenyl)propanamide IUPAC Name: 2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-N-(3-nitrophenyl)propanamide Traditional Name: 2-(4-indan-5-ylsulfonylpiperazino)-N-(3-nitrophenyl)propionamide Formula: C22H26N4O5S MolecularWeight: 458.53064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])N2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3

Isomeric SMILES

CC(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])N2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C22H26N4O5S/c1-16(22(27)23-19-6-3-7-20(15-19)26(28)29)24-10-12-25(13-11-24)32(30,31)21-9-8-17-4-2-5-18(17)14-21/h3,6-9,14-16H,2,4-5,10-13H2,1H3,(H,23,27)