3-chloranyl-N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-4-methyl-5-nitro-benzenesulfonamide

Systemtic Name: 3-chloranyl-N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-4-methyl-5-nitro-benzenesulfonamide Openeye Name: 3-chloro-N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-4-methyl-5-nitro-benzenesulfonamide CAS Name: 3-chloro-N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-4-methyl-5-nitrobenzenesulfonamide IUPAC Name: 3-chloro-N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-4-methyl-5-nitrobenzenesulfonamide Traditional Name: 3-chloro-N-cyclopropyl-4-methyl-5-nitro-N-p-anisyl-benzenesulfonamide Formula: C18H19ClN2O5S MolecularWeight: 410.87186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)N(CC2=CC=C(C=C2)OC)C3CC3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)N(CC2=CC=C(C=C2)OC)C3CC3)Cl

InChI

InChI=1S/C18H19ClN2O5S/c1-12-17(19)9-16(10-18(12)21(22)23)27(24,25)20(14-5-6-14)11-13-3-7-15(26-2)8-4-13/h3-4,7-10,14H,5-6,11H2,1-2H3