2-[[6-ethyl-2-(4-methylphenyl)chromen-4-ylidene]amino]-3-oxidanyl-propanoic acid

Systemtic Name: 2-[[6-ethyl-2-(4-methylphenyl)chromen-4-ylidene]amino]-3-oxidanyl-propanoic acid Openeye Name: 2-[[6-ethyl-2-(p-tolyl)chromen-4-ylidene]amino]-3-hydroxy-propanoic acid CAS Name: 2-[[6-ethyl-2-(4-methylphenyl)-1-benzopyran-4-ylidene]amino]-3-hydroxypropanoic acid IUPAC Name: 2-[[6-ethyl-2-(4-methylphenyl)chromen-4-ylidene]amino]-3-hydroxypropanoic acid Traditional Name: 2-[[6-ethyl-2-(p-tolyl)chromen-4-ylidene]amino]-3-hydroxy-propionic acid Formula: C21H21NO4 MolecularWeight: 351.39574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)OC(=CC2=NC(CO)C(=O)O)C3=CC=C(C=C3)C

Isomeric SMILES

CCC1=CC2=C(C=C1)OC(=CC2=NC(CO)C(=O)O)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H21NO4/c1-3-14-6-9-19-16(10-14)17(22-18(12-23)21(24)25)11-20(26-19)15-7-4-13(2)5-8-15/h4-11,18,23H,3,12H2,1-2H3,(H,24,25)