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

Systemtic Name: N-[4-(1,3-benzodioxol-5-ylmethyl)-2-methyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]-3,5-dimethoxy-benzamide Openeye Name: N-[4-(1,3-benzodioxol-5-ylmethyl)-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]-3,5-dimethoxy-benzamide CAS Name: N-[4-(1,3-benzodioxol-5-ylmethyl)-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]-3,5-dimethoxybenzamide IUPAC Name: N-[4-(1,3-benzodioxol-5-ylmethyl)-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]-3,5-dimethoxybenzamide Traditional Name: N-(3-keto-2-methyl-4-piperonyl-5H-1,4-benzoxazepin-7-yl)-3,5-dimethoxy-benzamide Formula: C27H26N2O7 MolecularWeight: 490.50454

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=CC(=CC(=C3)OC)OC)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=CC(=CC(=C3)OC)OC)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H26N2O7/c1-16-27(31)29(13-17-4-6-24-25(8-17)35-15-34-24)14-19-9-20(5-7-23(19)36-16)28-26(30)18-10-21(32-2)12-22(11-18)33-3/h4-12,16H,13-15H2,1-3H3,(H,28,30)