2-[[4-(methylamino)-3-nitro-phenyl]sulfonylamino]-N-(3-phenylpropyl)ethanamide

Systemtic Name: 2-[[4-(methylamino)-3-nitro-phenyl]sulfonylamino]-N-(3-phenylpropyl)ethanamide Openeye Name: 2-[[4-(methylamino)-3-nitro-phenyl]sulfonylamino]-N-(3-phenylpropyl)acetamide CAS Name: 2-[[4-(methylamino)-3-nitrophenyl]sulfonylamino]-N-(3-phenylpropyl)acetamide IUPAC Name: 2-[[4-(methylamino)-3-nitrophenyl]sulfonylamino]-N-(3-phenylpropyl)acetamide Traditional Name: 2-[[4-(methylamino)-3-nitro-phenyl]sulfonylamino]-N-(3-phenylpropyl)acetamide Formula: C18H22N4O5S MolecularWeight: 406.45608

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)S(=O)(=O)NCC(=O)NCCCC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)S(=O)(=O)NCC(=O)NCCCC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H22N4O5S/c1-19-16-10-9-15(12-17(16)22(24)25)28(26,27)21-13-18(23)20-11-5-8-14-6-3-2-4-7-14/h2-4,6-7,9-10,12,19,21H,5,8,11,13H2,1H3,(H,20,23)