(2R)-2-[(3-oxidanyl-6-oxidanylidene-benzo[c]chromen-4-yl)methylazaniumyl]-3-phenyl-propanoate

Systemtic Name: (2R)-2-[(3-oxidanyl-6-oxidanylidene-benzo[c]chromen-4-yl)methylazaniumyl]-3-phenyl-propanoate Openeye Name: (2R)-2-[(3-hydroxy-6-oxo-benzo[c]chromen-4-yl)methylammonio]-3-phenyl-propanoate CAS Name: (2R)-2-[(3-hydroxy-6-oxo-4-benzo[c][1]benzopyranyl)methylammonio]-3-phenylpropanoate IUPAC Name: (2R)-2-[(3-hydroxy-6-oxobenzo[c]chromen-4-yl)methylazaniumyl]-3-phenylpropanoate Traditional Name: (2R)-2-[(3-hydroxy-6-keto-benzo[c]chromen-4-yl)methylammonio]-3-phenyl-propionate Formula: C23H19NO5 MolecularWeight: 389.40066

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)[O-])[NH2+]CC2=C(C=CC3=C2OC(=O)C4=CC=CC=C34)O

Isomeric SMILES

C1=CC=C(C=C1)C[C@H](C(=O)[O-])[NH2+]CC2=C(C=CC3=C2OC(=O)C4=CC=CC=C34)O

InChI

InChI=1S/C23H19NO5/c25-20-11-10-16-15-8-4-5-9-17(15)23(28)29-21(16)18(20)13-24-19(22(26)27)12-14-6-2-1-3-7-14/h1-11,19,24-25H,12-13H2,(H,26,27)/t19-/m1/s1