methyl 2-[4-[(3-methylphenyl)amino]phthalazin-1-yl]ethanoate

Systemtic Name: methyl 2-[4-[(3-methylphenyl)amino]phthalazin-1-yl]ethanoate Openeye Name: methyl 2-[4-(3-methylanilino)phthalazin-1-yl]acetate CAS Name: 2-[4-(3-methylanilino)-1-phthalazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-(3-methylanilino)phthalazin-1-yl]acetate Traditional Name: 2-[4-(m-toluidino)phthalazin-1-yl]acetic acid methyl ester Formula: C18H17N3O2 MolecularWeight: 307.34648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NN=C(C3=CC=CC=C32)CC(=O)OC

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NN=C(C3=CC=CC=C32)CC(=O)OC

InChI

InChI=1S/C18H17N3O2/c1-12-6-5-7-13(10-12)19-18-15-9-4-3-8-14(15)16(20-21-18)11-17(22)23-2/h3-10H,11H2,1-2H3,(H,19,21)