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

Systemtic Name: (2S,3R)-3-methyl-2-[3-(4-methyl-7-oxidanyl-2-oxidanylidene-chromen-3-yl)propanoylamino]pentanoate Openeye Name: (2S,3R)-2-[3-(7-hydroxy-4-methyl-2-oxo-chromen-3-yl)propanoylamino]-3-methyl-pentanoate CAS Name: (2S,3R)-2-[[3-(7-hydroxy-4-methyl-2-oxo-1-benzopyran-3-yl)-1-oxopropyl]amino]-3-methylpentanoate IUPAC Name: (2S,3R)-2-[3-(7-hydroxy-4-methyl-2-oxochromen-3-yl)propanoylamino]-3-methylpentanoate Traditional Name: (2S,3R)-2-[3-(7-hydroxy-2-keto-4-methyl-chromen-3-yl)propanoylamino]-3-methyl-valerate Formula: C19H22NO6- MolecularWeight: 360.38108

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23NO6/c1-4-10(2)17(18(23)24)20-16(22)8-7-14-11(3)13-6-5-12(21)9-15(13)26-19(14)25/h5-6,9-10,17,21H,4,7-8H2,1-3H3,(H,20,22)(H,23,24)/p-1/t10-,17+/m1/s1