(4-methoxyphenyl)methyl 2-(7-methyl-2,3-dihydroindol-1-yl)pyrimidine-5-carboperoxoate

Systemtic Name: (4-methoxyphenyl)methyl 2-(7-methyl-2,3-dihydroindol-1-yl)pyrimidine-5-carboperoxoate Openeye Name: (4-methoxyphenyl)methyl 2-(7-methylindolin-1-yl)pyrimidine-5-carboperoxoate CAS Name: 2-(7-methyl-2,3-dihydroindol-1-yl)-5-pyrimidinecarboperoxoic acid (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)methyl 2-(7-methyl-2,3-dihydroindol-1-yl)pyrimidine-5-carboperoxoate Traditional Name: 2-(7-methylindolin-1-yl)pyrimidine-5-carboperoxoic acid p-anisyl ester Formula: C22H21N3O4 MolecularWeight: 391.41984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N(CC2)C3=NC=C(C=N3)C(=O)OOCC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=CC2=C1N(CC2)C3=NC=C(C=N3)C(=O)OOCC4=CC=C(C=C4)OC

InChI

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