2-(5,7-dimethoxy-6-methyl-2H-azepin-2-yl)isoindole-1,3-dione

Systemtic Name: 2-(5,7-dimethoxy-6-methyl-2H-azepin-2-yl)isoindole-1,3-dione Openeye Name: 2-(5,7-dimethoxy-6-methyl-2H-azepin-2-yl)isoindoline-1,3-dione CAS Name: 2-(5,7-dimethoxy-6-methyl-2H-azepin-2-yl)isoindole-1,3-dione IUPAC Name: 2-(5,7-dimethoxy-6-methyl-2H-azepin-2-yl)isoindole-1,3-dione Traditional Name: 2-(5,7-dimethoxy-6-methyl-2H-azepin-2-yl)isoindoline-1,3-quinone Formula: C17H16N2O4 MolecularWeight: 312.31994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(N=C1OC)N2C(=O)C3=CC=CC=C3C2=O)OC

Isomeric SMILES

CC1=C(C=CC(N=C1OC)N2C(=O)C3=CC=CC=C3C2=O)OC

InChI

InChI=1S/C17H16N2O4/c1-10-13(22-2)8-9-14(18-15(10)23-3)19-16(20)11-6-4-5-7-12(11)17(19)21/h4-9,14H,1-3H3