(2S)-2-[2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]pentanoate

Systemtic Name: (2S)-2-[2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]pentanoate Openeye Name: (2S)-2-[[2-(4-methyl-2-oxo-chromen-7-yl)oxyacetyl]amino]pentanoate CAS Name: (2S)-2-[[2-[(4-methyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxoethyl]amino]pentanoate IUPAC Name: (2S)-2-[[2-(4-methyl-2-oxochromen-7-yl)oxyacetyl]amino]pentanoate Traditional Name: (2S)-2-[[2-(2-keto-4-methyl-chromen-7-yl)oxyacetyl]amino]valerate Formula: C17H18NO6- MolecularWeight: 332.32792

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)[O-])NC(=O)COC1=CC2=C(C=C1)C(=CC(=O)O2)C

Isomeric SMILES

CCC[C@@H](C(=O)[O-])NC(=O)COC1=CC2=C(C=C1)C(=CC(=O)O2)C

InChI

InChI=1S/C17H19NO6/c1-3-4-13(17(21)22)18-15(19)9-23-11-5-6-12-10(2)7-16(20)24-14(12)8-11/h5-8,13H,3-4,9H2,1-2H3,(H,18,19)(H,21,22)/p-1/t13-/m0/s1