N-[4-[(4-chlorophenyl)methyl]-2-ethyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]-3,5-dimethoxy-benzamide

Systemtic Name: N-[4-[(4-chlorophenyl)methyl]-2-ethyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]-3,5-dimethoxy-benzamide Openeye Name: N-[4-[(4-chlorophenyl)methyl]-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl]-3,5-dimethoxy-benzamide CAS Name: N-[4-[(4-chlorophenyl)methyl]-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl]-3,5-dimethoxybenzamide IUPAC Name: N-[4-[(4-chlorophenyl)methyl]-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl]-3,5-dimethoxybenzamide Traditional Name: N-[4-(4-chlorobenzyl)-2-ethyl-3-keto-5H-1,4-benzoxazepin-7-yl]-3,5-dimethoxy-benzamide Formula: C27H27ClN2O5 MolecularWeight: 494.96668

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=CC(=CC(=C3)OC)OC)CC4=CC=C(C=C4)Cl

Isomeric SMILES

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=CC(=CC(=C3)OC)OC)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C27H27ClN2O5/c1-4-24-27(32)30(15-17-5-7-20(28)8-6-17)16-19-11-21(9-10-25(19)35-24)29-26(31)18-12-22(33-2)14-23(13-18)34-3/h5-14,24H,4,15-16H2,1-3H3,(H,29,31)