(2R)-2-[(7-oxidanyl-4-oxidanylidene-2,3-dihydro-1H-cyclopenta[c]chromen-6-yl)methylazaniumyl]propanoate

Systemtic Name: (2R)-2-[(7-oxidanyl-4-oxidanylidene-2,3-dihydro-1H-cyclopenta[c]chromen-6-yl)methylazaniumyl]propanoate Openeye Name: (2R)-2-[(7-hydroxy-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-6-yl)methylammonio]propanoate CAS Name: (2R)-2-[(7-hydroxy-4-oxo-2,3-dihydro-1H-cyclopenta[c][1]benzopyran-6-yl)methylammonio]propanoate IUPAC Name: (2R)-2-[(7-hydroxy-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-6-yl)methylazaniumyl]propanoate Traditional Name: (2R)-2-[(7-hydroxy-4-keto-2,3-dihydro-1H-cyclopenta[c]chromen-6-yl)methylammonio]propionate Formula: C16H17NO5 MolecularWeight: 303.30988

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])[NH2+]CC1=C(C=CC2=C1OC(=O)C3=C2CCC3)O

Isomeric SMILES

C[C@H](C(=O)[O-])[NH2+]CC1=C(C=CC2=C1OC(=O)C3=C2CCC3)O

InChI

InChI=1S/C16H17NO5/c1-8(15(19)20)17-7-12-13(18)6-5-10-9-3-2-4-11(9)16(21)22-14(10)12/h5-6,8,17-18H,2-4,7H2,1H3,(H,19,20)/t8-/m1/s1