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

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethyl)-3-[(3-chloranyl-2-methyl-phenyl)amino]-3H-isoindol-1-one Openeye Name: 2-(1,3-benzodioxol-5-ylmethyl)-3-(3-chloro-2-methyl-anilino)isoindolin-1-one CAS Name: 2-(1,3-benzodioxol-5-ylmethyl)-3-(3-chloro-2-methylanilino)-3H-isoindol-1-one IUPAC Name: 2-(1,3-benzodioxol-5-ylmethyl)-3-(3-chloro-2-methylanilino)-3H-isoindol-1-one Traditional Name: 3-(3-chloro-2-methyl-anilino)-2-piperonyl-isoindolin-1-one Formula: C23H19ClN2O3 MolecularWeight: 406.86156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC2C3=CC=CC=C3C(=O)N2CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC2C3=CC=CC=C3C(=O)N2CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H19ClN2O3/c1-14-18(24)7-4-8-19(14)25-22-16-5-2-3-6-17(16)23(27)26(22)12-15-9-10-20-21(11-15)29-13-28-20/h2-11,22,25H,12-13H2,1H3