1-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)methyl]-4-(3-nitrophenyl)sulfonyl-piperazine

Systemtic Name: 1-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)methyl]-4-(3-nitrophenyl)sulfonyl-piperazine Openeye Name: 1-[(1-cyclopropyltetrazol-5-yl)methyl]-4-(3-nitrophenyl)sulfonyl-piperazine CAS Name: 1-[(1-cyclopropyl-5-tetrazolyl)methyl]-4-(3-nitrophenyl)sulfonylpiperazine IUPAC Name: 1-[(1-cyclopropyltetrazol-5-yl)methyl]-4-(3-nitrophenyl)sulfonylpiperazine Traditional Name: 1-[(1-cyclopropyltetrazol-5-yl)methyl]-4-(3-nitrophenyl)sulfonyl-piperazine Formula: C15H19N7O4S MolecularWeight: 393.42086

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=N2)CN3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC1N2C(=NN=N2)CN3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C15H19N7O4S/c23-22(24)13-2-1-3-14(10-13)27(25,26)20-8-6-19(7-9-20)11-15-16-17-18-21(15)12-4-5-12/h1-3,10,12H,4-9,11H2