methyl 2-[4-[(4-methylphthalazin-1-yl)amino]phenoxy]ethanoate

Systemtic Name: methyl 2-[4-[(4-methylphthalazin-1-yl)amino]phenoxy]ethanoate Openeye Name: methyl 2-[4-[(4-methylphthalazin-1-yl)amino]phenoxy]acetate CAS Name: 2-[4-[(4-methyl-1-phthalazinyl)amino]phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[4-[(4-methylphthalazin-1-yl)amino]phenoxy]acetate Traditional Name: 2-[4-[(4-methylphthalazin-1-yl)amino]phenoxy]acetic acid methyl ester Formula: C18H17N3O3 MolecularWeight: 323.34588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(C2=CC=CC=C12)NC3=CC=C(C=C3)OCC(=O)OC

Isomeric SMILES

CC1=NN=C(C2=CC=CC=C12)NC3=CC=C(C=C3)OCC(=O)OC

InChI

InChI=1S/C18H17N3O3/c1-12-15-5-3-4-6-16(15)18(21-20-12)19-13-7-9-14(10-8-13)24-11-17(22)23-2/h3-10H,11H2,1-2H3,(H,19,21)