4-(cyclopentylamino)-N-(2,4-dimethylphenyl)-3-nitro-benzenesulfonamide

Systemtic Name: 4-(cyclopentylamino)-N-(2,4-dimethylphenyl)-3-nitro-benzenesulfonamide Openeye Name: 4-(cyclopentylamino)-N-(2,4-dimethylphenyl)-3-nitro-benzenesulfonamide CAS Name: 4-(cyclopentylamino)-N-(2,4-dimethylphenyl)-3-nitrobenzenesulfonamide IUPAC Name: 4-(cyclopentylamino)-N-(2,4-dimethylphenyl)-3-nitrobenzenesulfonamide Traditional Name: 4-(cyclopentylamino)-N-(2,4-dimethylphenyl)-3-nitro-benzenesulfonamide Formula: C19H23N3O4S MolecularWeight: 389.46862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)NC3CCCC3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)NC3CCCC3)[N+](=O)[O-])C

InChI

InChI=1S/C19H23N3O4S/c1-13-7-9-17(14(2)11-13)21-27(25,26)16-8-10-18(19(12-16)22(23)24)20-15-5-3-4-6-15/h7-12,15,20-21H,3-6H2,1-2H3