1-[(2-methoxy-5-methyl-phenyl)methyl]-4-(3-nitrophenyl)sulfonyl-piperazine

Systemtic Name: 1-[(2-methoxy-5-methyl-phenyl)methyl]-4-(3-nitrophenyl)sulfonyl-piperazine Openeye Name: 1-[(2-methoxy-5-methyl-phenyl)methyl]-4-(3-nitrophenyl)sulfonyl-piperazine CAS Name: 1-[(2-methoxy-5-methylphenyl)methyl]-4-(3-nitrophenyl)sulfonylpiperazine IUPAC Name: 1-[(2-methoxy-5-methylphenyl)methyl]-4-(3-nitrophenyl)sulfonylpiperazine Traditional Name: 1-(2-methoxy-5-methyl-benzyl)-4-(3-nitrophenyl)sulfonyl-piperazine Formula: C19H23N3O5S MolecularWeight: 405.46802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23N3O5S/c1-15-6-7-19(27-2)16(12-15)14-20-8-10-21(11-9-20)28(25,26)18-5-3-4-17(13-18)22(23)24/h3-7,12-13H,8-11,14H2,1-2H3