1-[(2,5-dimethylphenyl)methyl]-4-(4-nitrophenyl)sulfonyl-piperazine

Systemtic Name: 1-[(2,5-dimethylphenyl)methyl]-4-(4-nitrophenyl)sulfonyl-piperazine Openeye Name: 1-[(2,5-dimethylphenyl)methyl]-4-(4-nitrophenyl)sulfonyl-piperazine CAS Name: 1-[(2,5-dimethylphenyl)methyl]-4-(4-nitrophenyl)sulfonylpiperazine IUPAC Name: 1-[(2,5-dimethylphenyl)methyl]-4-(4-nitrophenyl)sulfonylpiperazine Traditional Name: 1-(2,5-dimethylbenzyl)-4-nosyl-piperazine Formula: C19H23N3O4S MolecularWeight: 389.46862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

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