ethyl 1-(1,4-diazepin-1-yl)-4-(6-methylpyridazin-3-yl)cyclohexane-1-carboperoxoate

Systemtic Name: ethyl 1-(1,4-diazepin-1-yl)-4-(6-methylpyridazin-3-yl)cyclohexane-1-carboperoxoate Openeye Name: ethyl 1-(1,4-diazepin-1-yl)-4-(6-methylpyridazin-3-yl)cyclohexanecarboperoxoate CAS Name: 1-(1,4-diazepin-1-yl)-4-(6-methyl-3-pyridazinyl)-1-cyclohexanecarboperoxoic acid ethyl ester IUPAC Name: ethyl 1-(1,4-diazepin-1-yl)-4-(6-methylpyridazin-3-yl)cyclohexane-1-carboperoxoate Traditional Name: 1-(1,4-diazepin-1-yl)-4-(6-methylpyridazin-3-yl)cyclohexanecarboperoxoic acid ethyl ester Formula: C19H24N4O3 MolecularWeight: 356.41886

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Descriptors Computed from Structure

Canonical SMILES:

CCOOC(=O)C1(CCC(CC1)C2=NN=C(C=C2)C)N3C=CC=NC=C3

Isomeric SMILES

CCOOC(=O)C1(CCC(CC1)C2=NN=C(C=C2)C)N3C=CC=NC=C3

InChI

InChI=1S/C19H24N4O3/c1-3-25-26-18(24)19(23-13-4-11-20-12-14-23)9-7-16(8-10-19)17-6-5-15(2)21-22-17/h4-6,11-14,16H,3,7-10H2,1-2H3