6-oxidanylidene-6-[8-[[4-(4-phenylbutoxy)phenyl]carbonylamino]-2-(2H-1,2,3,4-tetrazol-5-yl)-2,3-dihydro-1,4-benzoxazin-4-yl]hexanoic acid

Systemtic Name: 6-oxidanylidene-6-[8-[[4-(4-phenylbutoxy)phenyl]carbonylamino]-2-(2H-1,2,3,4-tetrazol-5-yl)-2,3-dihydro-1,4-benzoxazin-4-yl]hexanoic acid Openeye Name: 6-oxo-6-[8-[[4-(4-phenylbutoxy)benzoyl]amino]-2-(2H-tetrazol-5-yl)-2,3-dihydro-1,4-benzoxazin-4-yl]hexanoic acid CAS Name: 6-oxo-6-[8-[[oxo-[4-(4-phenylbutoxy)phenyl]methyl]amino]-2-(2H-tetrazol-5-yl)-2,3-dihydro-1,4-benzoxazin-4-yl]hexanoic acid IUPAC Name: 6-oxo-6-[8-[[4-(4-phenylbutoxy)benzoyl]amino]-2-(2H-tetrazol-5-yl)-2,3-dihydro-1,4-benzoxazin-4-yl]hexanoic acid Traditional Name: 6-keto-6-[8-[[4-(4-phenylbutoxy)benzoyl]amino]-2-(2H-tetrazol-5-yl)-2,3-dihydro-1,4-benzoxazin-4-yl]hexanoic acid Formula: C32H34N6O6 MolecularWeight: 598.64896

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C(N1C(=O)CCCCC(=O)O)C=CC=C2NC(=O)C3=CC=C(C=C3)OCCCCC4=CC=CC=C4)C5=NNN=N5

Isomeric SMILES

C1C(OC2=C(N1C(=O)CCCCC(=O)O)C=CC=C2NC(=O)C3=CC=C(C=C3)OCCCCC4=CC=CC=C4)C5=NNN=N5

InChI

InChI=1S/C32H34N6O6/c39-28(14-4-5-15-29(40)41)38-21-27(31-34-36-37-35-31)44-30-25(12-8-13-26(30)38)33-32(42)23-16-18-24(19-17-23)43-20-7-6-11-22-9-2-1-3-10-22/h1-3,8-10,12-13,16-19,27H,4-7,11,14-15,20-21H2,(H,33,42)(H,40,41)(H,34,35,36,37)