methyl (2S)-2-[[1,3-bis(oxidanylidene)-2-pyridin-2-yl-4H-isoquinolin-4-yl]methylideneamino]propanoate

Systemtic Name: methyl (2S)-2-[[1,3-bis(oxidanylidene)-2-pyridin-2-yl-4H-isoquinolin-4-yl]methylideneamino]propanoate Openeye Name: methyl (2S)-2-[[1,3-dioxo-2-(2-pyridyl)-4H-isoquinolin-4-yl]methyleneamino]propanoate CAS Name: (2S)-2-[[1,3-dioxo-2-(2-pyridinyl)-4H-isoquinolin-4-yl]methylideneamino]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(1,3-dioxo-2-pyridin-2-yl-4H-isoquinolin-4-yl)methylideneamino]propanoate Traditional Name: (2S)-2-[[1,3-diketo-2-(2-pyridyl)-4H-isoquinolin-4-yl]methyleneamino]propionic acid methyl ester Formula: C19H17N3O4 MolecularWeight: 351.35598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)N=CC1C2=CC=CC=C2C(=O)N(C1=O)C3=CC=CC=N3

Isomeric SMILES

C[C@@H](C(=O)OC)N=CC1C2=CC=CC=C2C(=O)N(C1=O)C3=CC=CC=N3

InChI

InChI=1S/C19H17N3O4/c1-12(19(25)26-2)21-11-15-13-7-3-4-8-14(13)17(23)22(18(15)24)16-9-5-6-10-20-16/h3-12,15H,1-2H3/t12-,15?/m0/s1