N-[4-(cyclopropylmethyl)-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]-2-methoxy-benzamide

Systemtic Name: N-[4-(cyclopropylmethyl)-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]-2-methoxy-benzamide Openeye Name: N-[4-(cyclopropylmethyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]-2-methoxy-benzamide CAS Name: N-[4-(cyclopropylmethyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]-2-methoxybenzamide IUPAC Name: N-[4-(cyclopropylmethyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]-2-methoxybenzamide Traditional Name: N-[4-(cyclopropylmethyl)-3-keto-5H-1,4-benzoxazepin-7-yl]-2-methoxy-benzamide Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC2=CC3=C(C=C2)OCC(=O)N(C3)CC4CC4

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC2=CC3=C(C=C2)OCC(=O)N(C3)CC4CC4

InChI

InChI=1S/C21H22N2O4/c1-26-19-5-3-2-4-17(19)21(25)22-16-8-9-18-15(10-16)12-23(11-14-6-7-14)20(24)13-27-18/h2-5,8-10,14H,6-7,11-13H2,1H3,(H,22,25)