(2R)-2-[(7-methyl-5-oxidanyl-2-oxidanylidene-4-phenyl-chromen-6-yl)methylazaniumyl]pentanoate

Systemtic Name: (2R)-2-[(7-methyl-5-oxidanyl-2-oxidanylidene-4-phenyl-chromen-6-yl)methylazaniumyl]pentanoate Openeye Name: (2R)-2-[(5-hydroxy-7-methyl-2-oxo-4-phenyl-chromen-6-yl)methylammonio]pentanoate CAS Name: (2R)-2-[(5-hydroxy-7-methyl-2-oxo-4-phenyl-1-benzopyran-6-yl)methylammonio]pentanoate IUPAC Name: (2R)-2-[(5-hydroxy-7-methyl-2-oxo-4-phenylchromen-6-yl)methylazaniumyl]pentanoate Traditional Name: (2R)-2-[(5-hydroxy-2-keto-7-methyl-4-phenyl-chromen-6-yl)methylammonio]valerate Formula: C22H23NO5 MolecularWeight: 381.42172

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)[O-])[NH2+]CC1=C(C2=C(C=C1C)OC(=O)C=C2C3=CC=CC=C3)O

Isomeric SMILES

CCC[C@H](C(=O)[O-])[NH2+]CC1=C(C2=C(C=C1C)OC(=O)C=C2C3=CC=CC=C3)O

InChI

InChI=1S/C22H23NO5/c1-3-7-17(22(26)27)23-12-16-13(2)10-18-20(21(16)25)15(11-19(24)28-18)14-8-5-4-6-9-14/h4-6,8-11,17,23,25H,3,7,12H2,1-2H3,(H,26,27)/t17-/m1/s1