4-[[(2S)-2-(4-butyl-2-oxidanylidene-chromen-7-yl)oxypropanoyl]amino]butanoate

Systemtic Name: 4-[[(2S)-2-(4-butyl-2-oxidanylidene-chromen-7-yl)oxypropanoyl]amino]butanoate Openeye Name: 4-[[(2S)-2-(4-butyl-2-oxo-chromen-7-yl)oxypropanoyl]amino]butanoate CAS Name: 4-[[(2S)-2-[(4-butyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxopropyl]amino]butanoate IUPAC Name: 4-[[(2S)-2-(4-butyl-2-oxochromen-7-yl)oxypropanoyl]amino]butanoate Traditional Name: 4-[[(2S)-2-(4-butyl-2-keto-chromen-7-yl)oxypropanoyl]amino]butyrate Formula: C20H24NO6- MolecularWeight: 374.40766

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=C1C=CC(=C2)OC(C)C(=O)NCCCC(=O)[O-]

Isomeric SMILES

CCCCC1=CC(=O)OC2=C1C=CC(=C2)O[C@@H](C)C(=O)NCCCC(=O)[O-]

InChI

InChI=1S/C20H25NO6/c1-3-4-6-14-11-19(24)27-17-12-15(8-9-16(14)17)26-13(2)20(25)21-10-5-7-18(22)23/h8-9,11-13H,3-7,10H2,1-2H3,(H,21,25)(H,22,23)/p-1/t13-/m0/s1