N-[4-[(4-chlorophenyl)methyl]-2-methyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]quinoxaline-2-carboxamide

Systemtic Name: N-[4-[(4-chlorophenyl)methyl]-2-methyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]quinoxaline-2-carboxamide Openeye Name: N-[4-[(4-chlorophenyl)methyl]-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]quinoxaline-2-carboxamide CAS Name: N-[4-[(4-chlorophenyl)methyl]-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]-2-quinoxalinecarboxamide IUPAC Name: N-[4-[(4-chlorophenyl)methyl]-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]quinoxaline-2-carboxamide Traditional Name: N-[4-(4-chlorobenzyl)-3-keto-2-methyl-5H-1,4-benzoxazepin-7-yl]quinoxaline-2-carboxamide Formula: C26H21ClN4O3 MolecularWeight: 472.92294

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=NC4=CC=CC=C4N=C3)CC5=CC=C(C=C5)Cl

Isomeric SMILES

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=NC4=CC=CC=C4N=C3)CC5=CC=C(C=C5)Cl

InChI

InChI=1S/C26H21ClN4O3/c1-16-26(33)31(14-17-6-8-19(27)9-7-17)15-18-12-20(10-11-24(18)34-16)29-25(32)23-13-28-21-4-2-3-5-22(21)30-23/h2-13,16H,14-15H2,1H3,(H,29,32)