(4-oxidanylidene-6-propyl-3-pyridin-2-yl-chromen-7-yl) 2-azanyl-3-phenyl-propanoate

Systemtic Name: (4-oxidanylidene-6-propyl-3-pyridin-2-yl-chromen-7-yl) 2-azanyl-3-phenyl-propanoate Openeye Name: [4-oxo-6-propyl-3-(2-pyridyl)chromen-7-yl] 2-amino-3-phenyl-propanoate CAS Name: 2-amino-3-phenylpropanoic acid [4-oxo-6-propyl-3-(2-pyridinyl)-1-benzopyran-7-yl] ester IUPAC Name: (4-oxo-6-propyl-3-pyridin-2-ylchromen-7-yl) 2-amino-3-phenylpropanoate Traditional Name: 2-amino-3-phenyl-propionic acid [4-keto-6-propyl-3-(2-pyridyl)chromen-7-yl] ester Formula: C26H24N2O4 MolecularWeight: 428.47976

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC=CC=N3)OC(=O)C(CC4=CC=CC=C4)N

Isomeric SMILES

CCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC=CC=N3)OC(=O)C(CC4=CC=CC=C4)N

InChI

InChI=1S/C26H24N2O4/c1-2-8-18-14-19-24(31-16-20(25(19)29)22-11-6-7-12-28-22)15-23(18)32-26(30)21(27)13-17-9-4-3-5-10-17/h3-7,9-12,14-16,21H,2,8,13,27H2,1H3