N-(3-methylphenyl)-4-(4-prop-2-ynoxyphenyl)phthalazin-1-amine

Systemtic Name: N-(3-methylphenyl)-4-(4-prop-2-ynoxyphenyl)phthalazin-1-amine Openeye Name: N-(m-tolyl)-4-(4-prop-2-ynoxyphenyl)phthalazin-1-amine CAS Name: N-(3-methylphenyl)-4-(4-prop-2-ynoxyphenyl)-1-phthalazinamine IUPAC Name: N-(3-methylphenyl)-4-(4-prop-2-ynoxyphenyl)phthalazin-1-amine Traditional Name: m-tolyl-[4-(4-propargyloxyphenyl)phthalazin-1-yl]amine Formula: C24H19N3O MolecularWeight: 365.42716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NN=C(C3=CC=CC=C32)C4=CC=C(C=C4)OCC#C

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NN=C(C3=CC=CC=C32)C4=CC=C(C=C4)OCC#C

InChI

InChI=1S/C24H19N3O/c1-3-15-28-20-13-11-18(12-14-20)23-21-9-4-5-10-22(21)24(27-26-23)25-19-8-6-7-17(2)16-19/h1,4-14,16H,15H2,2H3,(H,25,27)