N-[(4-ethylphenyl)methyl]-4-methoxy-3-nitro-N-(pyridin-3-ylmethyl)benzenesulfonamide

Systemtic Name: N-[(4-ethylphenyl)methyl]-4-methoxy-3-nitro-N-(pyridin-3-ylmethyl)benzenesulfonamide Openeye Name: N-[(4-ethylphenyl)methyl]-4-methoxy-3-nitro-N-(3-pyridylmethyl)benzenesulfonamide CAS Name: N-[(4-ethylphenyl)methyl]-4-methoxy-3-nitro-N-(3-pyridinylmethyl)benzenesulfonamide IUPAC Name: N-[(4-ethylphenyl)methyl]-4-methoxy-3-nitro-N-(pyridin-3-ylmethyl)benzenesulfonamide Traditional Name: N-(4-ethylbenzyl)-4-methoxy-3-nitro-N-(3-pyridylmethyl)benzenesulfonamide Formula: C22H23N3O5S MolecularWeight: 441.50012

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN(CC2=CN=CC=C2)S(=O)(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)CN(CC2=CN=CC=C2)S(=O)(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C22H23N3O5S/c1-3-17-6-8-18(9-7-17)15-24(16-19-5-4-12-23-14-19)31(28,29)20-10-11-22(30-2)21(13-20)25(26)27/h4-14H,3,15-16H2,1-2H3