methyl 3-[3-[3-[[(2-azanylpyridin-3-yl)amino]methyl]phenyl]phenyl]-3-oxidanylidene-propanoate

Systemtic Name: methyl 3-[3-[3-[[(2-azanylpyridin-3-yl)amino]methyl]phenyl]phenyl]-3-oxidanylidene-propanoate Openeye Name: methyl 3-[3-[3-[[(2-amino-3-pyridyl)amino]methyl]phenyl]phenyl]-3-oxo-propanoate CAS Name: 3-[3-[3-[[(2-amino-3-pyridinyl)amino]methyl]phenyl]phenyl]-3-oxopropanoic acid methyl ester IUPAC Name: methyl 3-[3-[3-[[(2-aminopyridin-3-yl)amino]methyl]phenyl]phenyl]-3-oxopropanoate Traditional Name: 3-[3-[3-[[(2-amino-3-pyridyl)amino]methyl]phenyl]phenyl]-3-keto-propionic acid methyl ester Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(=O)C1=CC=CC(=C1)C2=CC(=CC=C2)CNC3=C(N=CC=C3)N

Isomeric SMILES

COC(=O)CC(=O)C1=CC=CC(=C1)C2=CC(=CC=C2)CNC3=C(N=CC=C3)N

InChI

InChI=1S/C22H21N3O3/c1-28-21(27)13-20(26)18-8-3-7-17(12-18)16-6-2-5-15(11-16)14-25-19-9-4-10-24-22(19)23/h2-12,25H,13-14H2,1H3,(H2,23,24)