1-(4-methyl-3-nitro-phenyl)sulfonyl-4-[(2-methylphenyl)methyl]piperazine

Systemtic Name: 1-(4-methyl-3-nitro-phenyl)sulfonyl-4-[(2-methylphenyl)methyl]piperazine Openeye Name: 1-(4-methyl-3-nitro-phenyl)sulfonyl-4-(o-tolylmethyl)piperazine CAS Name: 1-(4-methyl-3-nitrophenyl)sulfonyl-4-[(2-methylphenyl)methyl]piperazine IUPAC Name: 1-(4-methyl-3-nitrophenyl)sulfonyl-4-[(2-methylphenyl)methyl]piperazine Traditional Name: 1-(2-methylbenzyl)-4-(4-methyl-3-nitro-phenyl)sulfonyl-piperazine Formula: C19H23N3O4S MolecularWeight: 389.46862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3C)[N+](=O)[O-]

InChI

InChI=1S/C19H23N3O4S/c1-15-5-3-4-6-17(15)14-20-9-11-21(12-10-20)27(25,26)18-8-7-16(2)19(13-18)22(23)24/h3-8,13H,9-12,14H2,1-2H3