N-[4-[(4-chlorophenyl)methyl]-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]-3,4-dimethoxy-benzamide

Systemtic Name: N-[4-[(4-chlorophenyl)methyl]-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]-3,4-dimethoxy-benzamide Openeye Name: N-[4-[(4-chlorophenyl)methyl]-3-oxo-5H-1,4-benzoxazepin-7-yl]-3,4-dimethoxy-benzamide CAS Name: N-[4-[(4-chlorophenyl)methyl]-3-oxo-5H-1,4-benzoxazepin-7-yl]-3,4-dimethoxybenzamide IUPAC Name: N-[4-[(4-chlorophenyl)methyl]-3-oxo-5H-1,4-benzoxazepin-7-yl]-3,4-dimethoxybenzamide Traditional Name: N-[4-(4-chlorobenzyl)-3-keto-5H-1,4-benzoxazepin-7-yl]-3,4-dimethoxy-benzamide Formula: C25H23ClN2O5 MolecularWeight: 466.91352

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)OCC(=O)N(C3)CC4=CC=C(C=C4)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)OCC(=O)N(C3)CC4=CC=C(C=C4)Cl)OC

InChI

InChI=1S/C25H23ClN2O5/c1-31-22-9-5-17(12-23(22)32-2)25(30)27-20-8-10-21-18(11-20)14-28(24(29)15-33-21)13-16-3-6-19(26)7-4-16/h3-12H,13-15H2,1-2H3,(H,27,30)