2-(1,3-benzodioxol-5-ylmethyl)-3-[(3-methoxyphenyl)amino]-3H-isoindol-1-one

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethyl)-3-[(3-methoxyphenyl)amino]-3H-isoindol-1-one Openeye Name: 2-(1,3-benzodioxol-5-ylmethyl)-3-(3-methoxyanilino)isoindolin-1-one CAS Name: 2-(1,3-benzodioxol-5-ylmethyl)-3-(3-methoxyanilino)-3H-isoindol-1-one IUPAC Name: 2-(1,3-benzodioxol-5-ylmethyl)-3-(3-methoxyanilino)-3H-isoindol-1-one Traditional Name: 3-(m-anisidino)-2-piperonyl-isoindolin-1-one Formula: C23H20N2O4 MolecularWeight: 388.4159

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC2C3=CC=CC=C3C(=O)N2CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC1=CC=CC(=C1)NC2C3=CC=CC=C3C(=O)N2CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H20N2O4/c1-27-17-6-4-5-16(12-17)24-22-18-7-2-3-8-19(18)23(26)25(22)13-15-9-10-20-21(11-15)29-14-28-20/h2-12,22,24H,13-14H2,1H3