N-[(2-methoxyphenyl)methyl]-4-(3-nitrophenyl)sulfonyl-piperazine-1-carboxamide

Systemtic Name: N-[(2-methoxyphenyl)methyl]-4-(3-nitrophenyl)sulfonyl-piperazine-1-carboxamide Openeye Name: N-[(2-methoxyphenyl)methyl]-4-(3-nitrophenyl)sulfonyl-piperazine-1-carboxamide CAS Name: N-[(2-methoxyphenyl)methyl]-4-(3-nitrophenyl)sulfonyl-1-piperazinecarboxamide IUPAC Name: N-[(2-methoxyphenyl)methyl]-4-(3-nitrophenyl)sulfonylpiperazine-1-carboxamide Traditional Name: 4-(3-nitrophenyl)sulfonyl-N-o-anisyl-piperazine-1-carboxamide Formula: C19H22N4O6S MolecularWeight: 434.46618

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CNC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1CNC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O6S/c1-29-18-8-3-2-5-15(18)14-20-19(24)21-9-11-22(12-10-21)30(27,28)17-7-4-6-16(13-17)23(25)26/h2-8,13H,9-12,14H2,1H3,(H,20,24)