methyl (2R)-2-[2-(6,7-dimethyl-1-benzofuran-3-yl)ethanoylamino]-3-oxidanyl-propanoate

Systemtic Name: methyl (2R)-2-[2-(6,7-dimethyl-1-benzofuran-3-yl)ethanoylamino]-3-oxidanyl-propanoate Openeye Name: methyl (2R)-2-[[2-(6,7-dimethylbenzofuran-3-yl)acetyl]amino]-3-hydroxy-propanoate CAS Name: (2R)-2-[[2-(6,7-dimethyl-3-benzofuranyl)-1-oxoethyl]amino]-3-hydroxypropanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[2-(6,7-dimethyl-1-benzofuran-3-yl)acetyl]amino]-3-hydroxypropanoate Traditional Name: (2R)-2-[[2-(6,7-dimethylbenzofuran-3-yl)acetyl]amino]-3-hydroxy-propionic acid methyl ester Formula: C16H19NO5 MolecularWeight: 305.32576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CO2)CC(=O)NC(CO)C(=O)OC)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CO2)CC(=O)N[C@H](CO)C(=O)OC)C

InChI

InChI=1S/C16H19NO5/c1-9-4-5-12-11(8-22-15(12)10(9)2)6-14(19)17-13(7-18)16(20)21-3/h4-5,8,13,18H,6-7H2,1-3H3,(H,17,19)/t13-/m1/s1