N-[[4-(2-methylphenyl)carbonyl-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]-N-phenyl-cyclopropanecarboxamide

Systemtic Name: N-[[4-(2-methylphenyl)carbonyl-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]-N-phenyl-cyclopropanecarboxamide Openeye Name: N-[[4-(2-methylbenzoyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]-N-phenyl-cyclopropanecarboxamide CAS Name: N-[[4-[(2-methylphenyl)-oxomethyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]-N-phenylcyclopropanecarboxamide IUPAC Name: N-[[4-(2-methylbenzoyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]-N-phenylcyclopropanecarboxamide Traditional Name: N-[(4-o-toluoyl-3,5-dihydro-2H-1,4-benzoxazepin-7-yl)methyl]-N-phenyl-cyclopropanecarboxamide Formula: C28H28N2O3 MolecularWeight: 440.53352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCOC3=C(C2)C=C(C=C3)CN(C4=CC=CC=C4)C(=O)C5CC5

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCOC3=C(C2)C=C(C=C3)CN(C4=CC=CC=C4)C(=O)C5CC5

InChI

InChI=1S/C28H28N2O3/c1-20-7-5-6-10-25(20)28(32)29-15-16-33-26-14-11-21(17-23(26)19-29)18-30(27(31)22-12-13-22)24-8-3-2-4-9-24/h2-11,14,17,22H,12-13,15-16,18-19H2,1H3