(2R)-2-[2-(6-chloranyl-4-methyl-7-oxidanyl-2-oxidanylidene-chromen-3-yl)ethanoylamino]-4-methyl-pentanoic acid

Systemtic Name: (2R)-2-[2-(6-chloranyl-4-methyl-7-oxidanyl-2-oxidanylidene-chromen-3-yl)ethanoylamino]-4-methyl-pentanoic acid Openeye Name: (2R)-2-[[2-(6-chloro-7-hydroxy-4-methyl-2-oxo-chromen-3-yl)acetyl]amino]-4-methyl-pentanoic acid CAS Name: (2R)-2-[[2-(6-chloro-7-hydroxy-4-methyl-2-oxo-1-benzopyran-3-yl)-1-oxoethyl]amino]-4-methylpentanoic acid IUPAC Name: (2R)-2-[[2-(6-chloro-7-hydroxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]-4-methylpentanoic acid Traditional Name: (2R)-2-[[2-(6-chloro-7-hydroxy-2-keto-4-methyl-chromen-3-yl)acetyl]amino]-4-methyl-valeric acid Formula: C18H20ClNO6 MolecularWeight: 381.8075

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)O)CC(=O)NC(CC(C)C)C(=O)O

Isomeric SMILES

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)O)CC(=O)N[C@H](CC(C)C)C(=O)O

InChI

InChI=1S/C18H20ClNO6/c1-8(2)4-13(17(23)24)20-16(22)6-11-9(3)10-5-12(19)14(21)7-15(10)26-18(11)25/h5,7-8,13,21H,4,6H2,1-3H3,(H,20,22)(H,23,24)/t13-/m1/s1