4-azanyl-N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)-3-nitro-benzamide

Systemtic Name: 4-azanyl-N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)-3-nitro-benzamide Openeye Name: 4-amino-N-[4-methoxy-3-(1-piperidylsulfonyl)phenyl]-3-nitro-benzamide CAS Name: 4-amino-N-[4-methoxy-3-(1-piperidinylsulfonyl)phenyl]-3-nitrobenzamide IUPAC Name: 4-amino-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-3-nitrobenzamide Traditional Name: 4-amino-N-(4-methoxy-3-piperidinosulfonyl-phenyl)-3-nitro-benzamide Formula: C19H22N4O6S MolecularWeight: 434.46618

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)N)[N+](=O)[O-])S(=O)(=O)N3CCCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)N)[N+](=O)[O-])S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C19H22N4O6S/c1-29-17-8-6-14(12-18(17)30(27,28)22-9-3-2-4-10-22)21-19(24)13-5-7-15(20)16(11-13)23(25)26/h5-8,11-12H,2-4,9-10,20H2,1H3,(H,21,24)