methyl 4-[[2-(3-methoxyphenyl)-1,3-benzoxazol-6-yl]carbonylamino]butanoate

Systemtic Name: methyl 4-[[2-(3-methoxyphenyl)-1,3-benzoxazol-6-yl]carbonylamino]butanoate Openeye Name: methyl 4-[[2-(3-methoxyphenyl)-1,3-benzoxazole-6-carbonyl]amino]butanoate CAS Name: 4-[[[2-(3-methoxyphenyl)-1,3-benzoxazol-6-yl]-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[2-(3-methoxyphenyl)-1,3-benzoxazole-6-carbonyl]amino]butanoate Traditional Name: 4-[[2-(3-methoxyphenyl)-1,3-benzoxazole-6-carbonyl]amino]butyric acid methyl ester Formula: C20H20N2O5 MolecularWeight: 368.3832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NC3=C(O2)C=C(C=C3)C(=O)NCCCC(=O)OC

Isomeric SMILES

COC1=CC=CC(=C1)C2=NC3=C(O2)C=C(C=C3)C(=O)NCCCC(=O)OC

InChI

InChI=1S/C20H20N2O5/c1-25-15-6-3-5-14(11-15)20-22-16-9-8-13(12-17(16)27-20)19(24)21-10-4-7-18(23)26-2/h3,5-6,8-9,11-12H,4,7,10H2,1-2H3,(H,21,24)