(2S)-2-[(7-oxidanyl-4-oxidanylidene-3-phenoxy-chromen-8-yl)methylazaniumyl]propanoate

Systemtic Name: (2S)-2-[(7-oxidanyl-4-oxidanylidene-3-phenoxy-chromen-8-yl)methylazaniumyl]propanoate Openeye Name: (2S)-2-[(7-hydroxy-4-oxo-3-phenoxy-chromen-8-yl)methylammonio]propanoate CAS Name: (2S)-2-[(7-hydroxy-4-oxo-3-phenoxy-1-benzopyran-8-yl)methylammonio]propanoate IUPAC Name: (2S)-2-[(7-hydroxy-4-oxo-3-phenoxychromen-8-yl)methylazaniumyl]propanoate Traditional Name: (2S)-2-[(7-hydroxy-4-keto-3-phenoxy-chromen-8-yl)methylammonio]propionate Formula: C19H17NO6 MolecularWeight: 355.34138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])[NH2+]CC1=C(C=CC2=C1OC=C(C2=O)OC3=CC=CC=C3)O

Isomeric SMILES

C[C@@H](C(=O)[O-])[NH2+]CC1=C(C=CC2=C1OC=C(C2=O)OC3=CC=CC=C3)O

InChI

InChI=1S/C19H17NO6/c1-11(19(23)24)20-9-14-15(21)8-7-13-17(22)16(10-25-18(13)14)26-12-5-3-2-4-6-12/h2-8,10-11,20-21H,9H2,1H3,(H,23,24)/t11-/m0/s1