1-[4-(4-methylpiperidin-1-yl)sulfonyl-2-nitro-phenyl]-4-phenethyl-piperazine

Systemtic Name: 1-[4-(4-methylpiperidin-1-yl)sulfonyl-2-nitro-phenyl]-4-phenethyl-piperazine Openeye Name: 1-[4-[(4-methyl-1-piperidyl)sulfonyl]-2-nitro-phenyl]-4-phenethyl-piperazine CAS Name: 1-[4-[(4-methyl-1-piperidinyl)sulfonyl]-2-nitrophenyl]-4-phenethylpiperazine IUPAC Name: 1-[4-(4-methylpiperidin-1-yl)sulfonyl-2-nitrophenyl]-4-phenethylpiperazine Traditional Name: 1-[4-(4-methylpiperidino)sulfonyl-2-nitro-phenyl]-4-phenethyl-piperazine Formula: C24H32N4O4S MolecularWeight: 472.60028

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCN(CC3)CCC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCN(CC3)CCC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H32N4O4S/c1-20-9-13-27(14-10-20)33(31,32)22-7-8-23(24(19-22)28(29)30)26-17-15-25(16-18-26)12-11-21-5-3-2-4-6-21/h2-8,19-20H,9-18H2,1H3