methyl 4-[4-[(phenylmethyl)amino]phthalazin-1-yl]benzoate

Systemtic Name: methyl 4-[4-[(phenylmethyl)amino]phthalazin-1-yl]benzoate Openeye Name: methyl 4-[4-(benzylamino)phthalazin-1-yl]benzoate CAS Name: 4-[4-[(phenylmethyl)amino]-1-phthalazinyl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-(benzylamino)phthalazin-1-yl]benzoate Traditional Name: 4-[4-(benzylamino)phthalazin-1-yl]benzoic acid methyl ester Formula: C23H19N3O2 MolecularWeight: 369.41586

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)NCC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)NCC4=CC=CC=C4

InChI

InChI=1S/C23H19N3O2/c1-28-23(27)18-13-11-17(12-14-18)21-19-9-5-6-10-20(19)22(26-25-21)24-15-16-7-3-2-4-8-16/h2-14H,15H2,1H3,(H,24,26)