5-[3-(hydroxymethyl)naphthalen-2-yl]oxy-4-oxidanylidene-3-(prop-2-enoxycarbonylamino)pentanoic acid

Systemtic Name: 5-[3-(hydroxymethyl)naphthalen-2-yl]oxy-4-oxidanylidene-3-(prop-2-enoxycarbonylamino)pentanoic acid Openeye Name: 3-(allyloxycarbonylamino)-5-[[3-(hydroxymethyl)-2-naphthyl]oxy]-4-oxo-pentanoic acid CAS Name: 5-[[3-(hydroxymethyl)-2-naphthalenyl]oxy]-4-oxo-3-[[oxo(prop-2-enoxy)methyl]amino]pentanoic acid IUPAC Name: 5-[3-(hydroxymethyl)naphthalen-2-yl]oxy-4-oxo-3-(prop-2-enoxycarbonylamino)pentanoic acid Traditional Name: 3-(allyloxycarbonylamino)-4-keto-5-(3-methylol-2-naphthoxy)valeric acid Formula: C20H21NO7 MolecularWeight: 387.38324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)NC(CC(=O)O)C(=O)COC1=CC2=CC=CC=C2C=C1CO

Isomeric SMILES

C=CCOC(=O)NC(CC(=O)O)C(=O)COC1=CC2=CC=CC=C2C=C1CO

InChI

InChI=1S/C20H21NO7/c1-2-7-27-20(26)21-16(10-19(24)25)17(23)12-28-18-9-14-6-4-3-5-13(14)8-15(18)11-22/h2-6,8-9,16,22H,1,7,10-12H2,(H,21,26)(H,24,25)