4-[2-[(2-chlorophenyl)sulfonylcarbamoyl]-8-[[4-(4-phenylbutoxy)phenyl]carbonylamino]-2,3-dihydro-1,4-benzoxazin-4-yl]butanoic acid

Systemtic Name: 4-[2-[(2-chlorophenyl)sulfonylcarbamoyl]-8-[[4-(4-phenylbutoxy)phenyl]carbonylamino]-2,3-dihydro-1,4-benzoxazin-4-yl]butanoic acid Openeye Name: 4-[2-[(2-chlorophenyl)sulfonylcarbamoyl]-8-[[4-(4-phenylbutoxy)benzoyl]amino]-2,3-dihydro-1,4-benzoxazin-4-yl]butanoic acid CAS Name: 4-[2-[[(2-chlorophenyl)sulfonylamino]-oxomethyl]-8-[[oxo-[4-(4-phenylbutoxy)phenyl]methyl]amino]-2,3-dihydro-1,4-benzoxazin-4-yl]butanoic acid IUPAC Name: 4-[2-[(2-chlorophenyl)sulfonylcarbamoyl]-8-[[4-(4-phenylbutoxy)benzoyl]amino]-2,3-dihydro-1,4-benzoxazin-4-yl]butanoic acid Traditional Name: 4-[2-[(2-chlorophenyl)sulfonylcarbamoyl]-8-[[4-(4-phenylbutoxy)benzoyl]amino]-2,3-dihydro-1,4-benzoxazin-4-yl]butyric acid Formula: C36H36ClN3O8S MolecularWeight: 706.20434

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C(N1CCCC(=O)O)C=CC=C2NC(=O)C3=CC=C(C=C3)OCCCCC4=CC=CC=C4)C(=O)NS(=O)(=O)C5=CC=CC=C5Cl

Isomeric SMILES

C1C(OC2=C(N1CCCC(=O)O)C=CC=C2NC(=O)C3=CC=C(C=C3)OCCCCC4=CC=CC=C4)C(=O)NS(=O)(=O)C5=CC=CC=C5Cl

InChI

InChI=1S/C36H36ClN3O8S/c37-28-13-4-5-16-32(28)49(45,46)39-36(44)31-24-40(22-9-17-33(41)42)30-15-8-14-29(34(30)48-31)38-35(43)26-18-20-27(21-19-26)47-23-7-6-12-25-10-2-1-3-11-25/h1-5,8,10-11,13-16,18-21,31H,6-7,9,12,17,22-24H2,(H,38,43)(H,39,44)(H,41,42)