(2R)-2-[2-(6-chloranyl-7-methoxy-4-methyl-2-oxidanylidene-chromen-3-yl)ethanoylamino]pentanoate

Systemtic Name: (2R)-2-[2-(6-chloranyl-7-methoxy-4-methyl-2-oxidanylidene-chromen-3-yl)ethanoylamino]pentanoate Openeye Name: (2R)-2-[[2-(6-chloro-7-methoxy-4-methyl-2-oxo-chromen-3-yl)acetyl]amino]pentanoate CAS Name: (2R)-2-[[2-(6-chloro-7-methoxy-4-methyl-2-oxo-1-benzopyran-3-yl)-1-oxoethyl]amino]pentanoate IUPAC Name: (2R)-2-[[2-(6-chloro-7-methoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]pentanoate Traditional Name: (2R)-2-[[2-(6-chloro-2-keto-7-methoxy-4-methyl-chromen-3-yl)acetyl]amino]valerate Formula: C18H19ClNO6- MolecularWeight: 380.79956

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)[O-])NC(=O)CC1=C(C2=CC(=C(C=C2OC1=O)OC)Cl)C

Isomeric SMILES

CCC[C@H](C(=O)[O-])NC(=O)CC1=C(C2=CC(=C(C=C2OC1=O)OC)Cl)C

InChI

InChI=1S/C18H20ClNO6/c1-4-5-13(17(22)23)20-16(21)7-11-9(2)10-6-12(19)15(25-3)8-14(10)26-18(11)24/h6,8,13H,4-5,7H2,1-3H3,(H,20,21)(H,22,23)/p-1/t13-/m1/s1