N-butyl-4-[butyl(3-phenylpropyl)amino]-3-nitro-N-(3-phenylpropyl)benzenesulfonamide

Systemtic Name: N-butyl-4-[butyl(3-phenylpropyl)amino]-3-nitro-N-(3-phenylpropyl)benzenesulfonamide Openeye Name: N-butyl-4-[butyl(3-phenylpropyl)amino]-3-nitro-N-(3-phenylpropyl)benzenesulfonamide CAS Name: N-butyl-4-[butyl(3-phenylpropyl)amino]-3-nitro-N-(3-phenylpropyl)benzenesulfonamide IUPAC Name: N-butyl-4-[butyl(3-phenylpropyl)amino]-3-nitro-N-(3-phenylpropyl)benzenesulfonamide Traditional Name: N-butyl-4-[butyl(3-phenylpropyl)amino]-3-nitro-N-(3-phenylpropyl)benzenesulfonamide Formula: C32H43N3O4S MolecularWeight: 565.76652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC1=CC=CC=C1)C2=C(C=C(C=C2)S(=O)(=O)N(CCCC)CCCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCN(CCCC1=CC=CC=C1)C2=C(C=C(C=C2)S(=O)(=O)N(CCCC)CCCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C32H43N3O4S/c1-3-5-23-33(24-13-19-28-15-9-7-10-16-28)31-22-21-30(27-32(31)35(36)37)40(38,39)34(25-6-4-2)26-14-20-29-17-11-8-12-18-29/h7-12,15-18,21-22,27H,3-6,13-14,19-20,23-26H2,1-2H3