N-(3-methylphenyl)-4-(1,3,5-trioxan-2-yl)phthalazin-1-amine

Systemtic Name: N-(3-methylphenyl)-4-(1,3,5-trioxan-2-yl)phthalazin-1-amine Openeye Name: N-(m-tolyl)-4-(1,3,5-trioxan-2-yl)phthalazin-1-amine CAS Name: N-(3-methylphenyl)-4-(1,3,5-trioxan-2-yl)-1-phthalazinamine IUPAC Name: N-(3-methylphenyl)-4-(1,3,5-trioxan-2-yl)phthalazin-1-amine Traditional Name: m-tolyl-[4-(1,3,5-trioxan-2-yl)phthalazin-1-yl]amine Formula: C18H17N3O3 MolecularWeight: 323.34588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NN=C(C3=CC=CC=C32)C4OCOCO4

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NN=C(C3=CC=CC=C32)C4OCOCO4

InChI

InChI=1S/C18H17N3O3/c1-12-5-4-6-13(9-12)19-17-15-8-3-2-7-14(15)16(20-21-17)18-23-10-22-11-24-18/h2-9,18H,10-11H2,1H3,(H,19,21)