(2S,3S)-2-[2-(3,4-dimethyl-2-oxidanylidene-chromen-7-yl)oxypropanoylamino]-3-methyl-pentanoic acid

Systemtic Name: (2S,3S)-2-[2-(3,4-dimethyl-2-oxidanylidene-chromen-7-yl)oxypropanoylamino]-3-methyl-pentanoic acid Openeye Name: (2S,3S)-2-[2-(3,4-dimethyl-2-oxo-chromen-7-yl)oxypropanoylamino]-3-methyl-pentanoic acid CAS Name: (2S,3S)-2-[[2-[(3,4-dimethyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxopropyl]amino]-3-methylpentanoic acid IUPAC Name: (2S,3S)-2-[2-(3,4-dimethyl-2-oxochromen-7-yl)oxypropanoylamino]-3-methylpentanoic acid Traditional Name: (2S,3S)-2-[2-(2-keto-3,4-dimethyl-chromen-7-yl)oxypropanoylamino]-3-methyl-valeric acid Formula: C20H25NO6 MolecularWeight: 375.4156

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)C(C)OC1=CC2=C(C=C1)C(=C(C(=O)O2)C)C

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)O)NC(=O)C(C)OC1=CC2=C(C=C1)C(=C(C(=O)O2)C)C

InChI

InChI=1S/C20H25NO6/c1-6-10(2)17(19(23)24)21-18(22)13(5)26-14-7-8-15-11(3)12(4)20(25)27-16(15)9-14/h7-10,13,17H,6H2,1-5H3,(H,21,22)(H,23,24)/t10-,13?,17-/m0/s1