N-cyclopropyl-N-[(4-ethylphenyl)methyl]-2-methoxy-5-nitro-benzenesulfonamide

Systemtic Name: N-cyclopropyl-N-[(4-ethylphenyl)methyl]-2-methoxy-5-nitro-benzenesulfonamide Openeye Name: N-cyclopropyl-N-[(4-ethylphenyl)methyl]-2-methoxy-5-nitro-benzenesulfonamide CAS Name: N-cyclopropyl-N-[(4-ethylphenyl)methyl]-2-methoxy-5-nitrobenzenesulfonamide IUPAC Name: N-cyclopropyl-N-[(4-ethylphenyl)methyl]-2-methoxy-5-nitrobenzenesulfonamide Traditional Name: N-cyclopropyl-N-(4-ethylbenzyl)-2-methoxy-5-nitro-benzenesulfonamide Formula: C19H22N2O5S MolecularWeight: 390.45338

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN(C2CC2)S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])OC

Isomeric SMILES

CCC1=CC=C(C=C1)CN(C2CC2)S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C19H22N2O5S/c1-3-14-4-6-15(7-5-14)13-20(16-8-9-16)27(24,25)19-12-17(21(22)23)10-11-18(19)26-2/h4-7,10-12,16H,3,8-9,13H2,1-2H3