(3-methoxyphenyl)methyl 2-(2-methyl-2,3-dihydroindol-1-yl)pyrimidine-5-carboperoxoate

Systemtic Name: (3-methoxyphenyl)methyl 2-(2-methyl-2,3-dihydroindol-1-yl)pyrimidine-5-carboperoxoate Openeye Name: (3-methoxyphenyl)methyl 2-(2-methylindolin-1-yl)pyrimidine-5-carboperoxoate CAS Name: 2-(2-methyl-2,3-dihydroindol-1-yl)-5-pyrimidinecarboperoxoic acid (3-methoxyphenyl)methyl ester IUPAC Name: (3-methoxyphenyl)methyl 2-(2-methyl-2,3-dihydroindol-1-yl)pyrimidine-5-carboperoxoate Traditional Name: 2-(2-methylindolin-1-yl)pyrimidine-5-carboperoxoic acid m-anisyl ester Formula: C22H21N3O4 MolecularWeight: 391.41984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C3=NC=C(C=N3)C(=O)OOCC4=CC(=CC=C4)OC

Isomeric SMILES

CC1CC2=CC=CC=C2N1C3=NC=C(C=N3)C(=O)OOCC4=CC(=CC=C4)OC

InChI

InChI=1S/C22H21N3O4/c1-15-10-17-7-3-4-9-20(17)25(15)22-23-12-18(13-24-22)21(26)29-28-14-16-6-5-8-19(11-16)27-2/h3-9,11-13,15H,10,14H2,1-2H3