methyl 4-(2-azanyl-3-cyano-7-methyl-5-oxidanylidene-6-phenethyl-4H-pyrano[3,2-c]pyridin-4-yl)benzoate

Systemtic Name: methyl 4-(2-azanyl-3-cyano-7-methyl-5-oxidanylidene-6-phenethyl-4H-pyrano[3,2-c]pyridin-4-yl)benzoate Openeye Name: methyl 4-(2-amino-3-cyano-7-methyl-5-oxo-6-phenethyl-4H-pyrano[3,2-c]pyridin-4-yl)benzoate CAS Name: 4-(2-amino-3-cyano-7-methyl-5-oxo-6-phenethyl-4H-pyrano[3,2-c]pyridin-4-yl)benzoic acid methyl ester IUPAC Name: methyl 4-(2-amino-3-cyano-7-methyl-5-oxo-6-phenethyl-4H-pyrano[3,2-c]pyridin-4-yl)benzoate Traditional Name: 4-(2-amino-3-cyano-5-keto-7-methyl-6-phenethyl-4H-pyrano[3,2-c]pyridin-4-yl)benzoic acid methyl ester Formula: C26H23N3O4 MolecularWeight: 441.47852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(C(=C(O2)N)C#N)C3=CC=C(C=C3)C(=O)OC)C(=O)N1CCC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C(C(=C(O2)N)C#N)C3=CC=C(C=C3)C(=O)OC)C(=O)N1CCC4=CC=CC=C4

InChI

InChI=1S/C26H23N3O4/c1-16-14-21-23(25(30)29(16)13-12-17-6-4-3-5-7-17)22(20(15-27)24(28)33-21)18-8-10-19(11-9-18)26(31)32-2/h3-11,14,22H,12-13,28H2,1-2H3