N-methyl-3-nitro-4-(1-phenylbutylamino)benzenesulfonamide

Systemtic Name: N-methyl-3-nitro-4-(1-phenylbutylamino)benzenesulfonamide Openeye Name: N-methyl-3-nitro-4-(1-phenylbutylamino)benzenesulfonamide CAS Name: N-methyl-3-nitro-4-(1-phenylbutylamino)benzenesulfonamide IUPAC Name: N-methyl-3-nitro-4-(1-phenylbutylamino)benzenesulfonamide Traditional Name: N-methyl-3-nitro-4-(1-phenylbutylamino)benzenesulfonamide Formula: C17H21N3O4S MolecularWeight: 363.43134

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)NC2=C(C=C(C=C2)S(=O)(=O)NC)[N+](=O)[O-]

Isomeric SMILES

CCCC(C1=CC=CC=C1)NC2=C(C=C(C=C2)S(=O)(=O)NC)[N+](=O)[O-]

InChI

InChI=1S/C17H21N3O4S/c1-3-7-15(13-8-5-4-6-9-13)19-16-11-10-14(25(23,24)18-2)12-17(16)20(21)22/h4-6,8-12,15,18-19H,3,7H2,1-2H3