(2S)-2-[(3-oxidanyl-6-oxidanylidene-benzo[c]chromen-4-yl)methylazaniumyl]pentanoate

Systemtic Name: (2S)-2-[(3-oxidanyl-6-oxidanylidene-benzo[c]chromen-4-yl)methylazaniumyl]pentanoate Openeye Name: (2S)-2-[(3-hydroxy-6-oxo-benzo[c]chromen-4-yl)methylammonio]pentanoate CAS Name: (2S)-2-[(3-hydroxy-6-oxo-4-benzo[c][1]benzopyranyl)methylammonio]pentanoate IUPAC Name: (2S)-2-[(3-hydroxy-6-oxobenzo[c]chromen-4-yl)methylazaniumyl]pentanoate Traditional Name: (2S)-2-[(3-hydroxy-6-keto-benzo[c]chromen-4-yl)methylammonio]valerate Formula: C19H19NO5 MolecularWeight: 341.35786

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)[O-])[NH2+]CC1=C(C=CC2=C1OC(=O)C3=CC=CC=C23)O

Isomeric SMILES

CCC[C@@H](C(=O)[O-])[NH2+]CC1=C(C=CC2=C1OC(=O)C3=CC=CC=C23)O

InChI

InChI=1S/C19H19NO5/c1-2-5-15(18(22)23)20-10-14-16(21)9-8-12-11-6-3-4-7-13(11)19(24)25-17(12)14/h3-4,6-9,15,20-21H,2,5,10H2,1H3,(H,22,23)/t15-/m0/s1