2-[(5-chloranyl-2-methoxy-phenyl)-(4-methyl-3-nitro-phenyl)sulfonyl-amino]-N-(3-phenylpropyl)ethanamide

Systemtic Name: 2-[(5-chloranyl-2-methoxy-phenyl)-(4-methyl-3-nitro-phenyl)sulfonyl-amino]-N-(3-phenylpropyl)ethanamide Openeye Name: 2-(5-chloro-2-methoxy-N-(4-methyl-3-nitro-phenyl)sulfonyl-anilino)-N-(3-phenylpropyl)acetamide CAS Name: 2-(5-chloro-2-methoxy-N-(4-methyl-3-nitrophenyl)sulfonylanilino)-N-(3-phenylpropyl)acetamide IUPAC Name: 2-(5-chloro-2-methoxy-N-(4-methyl-3-nitrophenyl)sulfonylanilino)-N-(3-phenylpropyl)acetamide Traditional Name: 2-(5-chloro-2-methoxy-N-(4-methyl-3-nitro-phenyl)sulfonyl-anilino)-N-(3-phenylpropyl)acetamide Formula: C25H26ClN3O6S MolecularWeight: 532.00844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(CC(=O)NCCCC2=CC=CC=C2)C3=C(C=CC(=C3)Cl)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(CC(=O)NCCCC2=CC=CC=C2)C3=C(C=CC(=C3)Cl)OC)[N+](=O)[O-]

InChI

InChI=1S/C25H26ClN3O6S/c1-18-10-12-21(16-22(18)29(31)32)36(33,34)28(23-15-20(26)11-13-24(23)35-2)17-25(30)27-14-6-9-19-7-4-3-5-8-19/h3-5,7-8,10-13,15-16H,6,9,14,17H2,1-2H3,(H,27,30)