(2S,3R)-2-[3-(7-methoxy-4-methyl-2-oxidanylidene-chromen-3-yl)propanoylamino]-3-methyl-pentanoate

Systemtic Name: (2S,3R)-2-[3-(7-methoxy-4-methyl-2-oxidanylidene-chromen-3-yl)propanoylamino]-3-methyl-pentanoate Openeye Name: (2S,3R)-2-[3-(7-methoxy-4-methyl-2-oxo-chromen-3-yl)propanoylamino]-3-methyl-pentanoate CAS Name: (2S,3R)-2-[[3-(7-methoxy-4-methyl-2-oxo-1-benzopyran-3-yl)-1-oxopropyl]amino]-3-methylpentanoate IUPAC Name: (2S,3R)-2-[3-(7-methoxy-4-methyl-2-oxochromen-3-yl)propanoylamino]-3-methylpentanoate Traditional Name: (2S,3R)-2-[3-(2-keto-7-methoxy-4-methyl-chromen-3-yl)propanoylamino]-3-methyl-valerate Formula: C20H24NO6- MolecularWeight: 374.40766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)[O-])NC(=O)CCC1=C(C2=C(C=C(C=C2)OC)OC1=O)C

Isomeric SMILES

CC[C@@H](C)[C@@H](C(=O)[O-])NC(=O)CCC1=C(C2=C(C=C(C=C2)OC)OC1=O)C

InChI

InChI=1S/C20H25NO6/c1-5-11(2)18(19(23)24)21-17(22)9-8-15-12(3)14-7-6-13(26-4)10-16(14)27-20(15)25/h6-7,10-11,18H,5,8-9H2,1-4H3,(H,21,22)(H,23,24)/p-1/t11-,18+/m1/s1