2-[[3-(azepan-1-ylcarbonyl)-4-methoxy-phenyl]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[3-(azepan-1-ylcarbonyl)-4-methoxy-phenyl]methyl]isoindole-1,3-dione Openeye Name: 2-[[3-(azepane-1-carbonyl)-4-methoxy-phenyl]methyl]isoindoline-1,3-dione CAS Name: 2-[[3-[1-azepanyl(oxo)methyl]-4-methoxyphenyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[3-(azepane-1-carbonyl)-4-methoxyphenyl]methyl]isoindole-1,3-dione Traditional Name: 2-[3-(azepane-1-carbonyl)-4-methoxy-benzyl]isoindoline-1,3-quinone Formula: C23H24N2O4 MolecularWeight: 392.44766

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2C(=O)C3=CC=CC=C3C2=O)C(=O)N4CCCCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)CN2C(=O)C3=CC=CC=C3C2=O)C(=O)N4CCCCCC4

InChI

InChI=1S/C23H24N2O4/c1-29-20-11-10-16(14-19(20)21(26)24-12-6-2-3-7-13-24)15-25-22(27)17-8-4-5-9-18(17)23(25)28/h4-5,8-11,14H,2-3,6-7,12-13,15H2,1H3