cyclopentyl-[4-[4-(3-methylpiperidin-1-yl)sulfonyl-2-nitro-phenyl]-1,4-diazepan-1-yl]methanone

Systemtic Name: cyclopentyl-[4-[4-(3-methylpiperidin-1-yl)sulfonyl-2-nitro-phenyl]-1,4-diazepan-1-yl]methanone Openeye Name: cyclopentyl-[4-[4-[(3-methyl-1-piperidyl)sulfonyl]-2-nitro-phenyl]-1,4-diazepan-1-yl]methanone CAS Name: cyclopentyl-[4-[4-[(3-methyl-1-piperidinyl)sulfonyl]-2-nitrophenyl]-1,4-diazepan-1-yl]methanone IUPAC Name: cyclopentyl-[4-[4-(3-methylpiperidin-1-yl)sulfonyl-2-nitrophenyl]-1,4-diazepan-1-yl]methanone Traditional Name: cyclopentyl-[4-[4-(3-methylpiperidino)sulfonyl-2-nitro-phenyl]-1,4-diazepan-1-yl]methanone Formula: C23H34N4O5S MolecularWeight: 478.60486

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC(=C(C=C2)N3CCCN(CC3)C(=O)C4CCCC4)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC(=C(C=C2)N3CCCN(CC3)C(=O)C4CCCC4)[N+](=O)[O-]

InChI

InChI=1S/C23H34N4O5S/c1-18-6-4-13-26(17-18)33(31,32)20-9-10-21(22(16-20)27(29)30)24-11-5-12-25(15-14-24)23(28)19-7-2-3-8-19/h9-10,16,18-19H,2-8,11-15,17H2,1H3