3-[[3-aminocarbonyl-5-(hydroxymethyl)-8-methyl-pyrano[2,3-c]pyridin-2-ylidene]amino]benzoic acid

Systemtic Name: 3-[[3-aminocarbonyl-5-(hydroxymethyl)-8-methyl-pyrano[2,3-c]pyridin-2-ylidene]amino]benzoic acid Openeye Name: 3-[[3-carbamoyl-5-(hydroxymethyl)-8-methyl-pyrano[2,3-c]pyridin-2-ylidene]amino]benzoic acid CAS Name: 3-[[3-carbamoyl-5-(hydroxymethyl)-8-methyl-2-pyrano[2,3-c]pyridinylidene]amino]benzoic acid IUPAC Name: 3-[[3-carbamoyl-5-(hydroxymethyl)-8-methylpyrano[2,3-c]pyridin-2-ylidene]amino]benzoic acid Traditional Name: 3-[(3-carbamoyl-8-methyl-5-methylol-pyrano[2,3-c]pyridin-2-ylidene)amino]benzoic acid Formula: C18H15N3O5 MolecularWeight: 353.3288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C2=C1OC(=NC3=CC=CC(=C3)C(=O)O)C(=C2)C(=O)N)CO

Isomeric SMILES

CC1=NC=C(C2=C1OC(=NC3=CC=CC(=C3)C(=O)O)C(=C2)C(=O)N)CO

InChI

InChI=1S/C18H15N3O5/c1-9-15-13(11(8-22)7-20-9)6-14(16(19)23)17(26-15)21-12-4-2-3-10(5-12)18(24)25/h2-7,22H,8H2,1H3,(H2,19,23)(H,24,25)