4-[3-[[(2S)-butan-2-yl]carbamoyl]-2-oxidanylidene-chromen-7-yl]oxybutanoate

Systemtic Name: 4-[3-[[(2S)-butan-2-yl]carbamoyl]-2-oxidanylidene-chromen-7-yl]oxybutanoate Openeye Name: 4-[3-[[(1S)-1-methylpropyl]carbamoyl]-2-oxo-chromen-7-yl]oxybutanoate CAS Name: 4-[[3-[[[(2S)-butan-2-yl]amino]-oxomethyl]-2-oxo-1-benzopyran-7-yl]oxy]butanoate IUPAC Name: 4-[3-[[(2S)-butan-2-yl]carbamoyl]-2-oxochromen-7-yl]oxybutanoate Traditional Name: 4-[2-keto-3-[[(1S)-1-methylpropyl]carbamoyl]chromen-7-yl]oxybutyrate Formula: C18H20NO6- MolecularWeight: 346.3545

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC2=C(C=C(C=C2)OCCCC(=O)[O-])OC1=O

Isomeric SMILES

CC[C@H](C)NC(=O)C1=CC2=C(C=C(C=C2)OCCCC(=O)[O-])OC1=O

InChI

InChI=1S/C18H21NO6/c1-3-11(2)19-17(22)14-9-12-6-7-13(10-15(12)25-18(14)23)24-8-4-5-16(20)21/h6-7,9-11H,3-5,8H2,1-2H3,(H,19,22)(H,20,21)/p-1/t11-/m0/s1