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

Systemtic Name: N-[4-(1,3-benzodioxol-5-ylmethyl)-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]-3-methoxy-benzamide Openeye Name: N-[4-(1,3-benzodioxol-5-ylmethyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]-3-methoxy-benzamide CAS Name: N-[4-(1,3-benzodioxol-5-ylmethyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]-3-methoxybenzamide IUPAC Name: N-[4-(1,3-benzodioxol-5-ylmethyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]-3-methoxybenzamide Traditional Name: N-(3-keto-4-piperonyl-5H-1,4-benzoxazepin-7-yl)-3-methoxy-benzamide Formula: C25H22N2O6 MolecularWeight: 446.45198

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NC2=CC3=C(C=C2)OCC(=O)N(C3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)NC2=CC3=C(C=C2)OCC(=O)N(C3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H22N2O6/c1-30-20-4-2-3-17(11-20)25(29)26-19-6-8-21-18(10-19)13-27(24(28)14-31-21)12-16-5-7-22-23(9-16)33-15-32-22/h2-11H,12-15H2,1H3,(H,26,29)