(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl-[(2S)-2-oxidanyl-2-phenyl-ethyl]azanium

Systemtic Name: (8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl-[(2S)-2-oxidanyl-2-phenyl-ethyl]azanium Openeye Name: (7-hydroxy-8-methyl-2-oxo-chromen-4-yl)methyl-[(2S)-2-hydroxy-2-phenyl-ethyl]ammonium CAS Name: (7-hydroxy-8-methyl-2-oxo-1-benzopyran-4-yl)methyl-[(2S)-2-hydroxy-2-phenylethyl]ammonium IUPAC Name: (7-hydroxy-8-methyl-2-oxochromen-4-yl)methyl-[(2S)-2-hydroxy-2-phenylethyl]azanium Traditional Name: (7-hydroxy-2-keto-8-methyl-chromen-4-yl)methyl-[(2S)-2-hydroxy-2-phenyl-ethyl]ammonium Formula: C19H20NO4+ MolecularWeight: 326.3664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2C[NH2+]CC(C3=CC=CC=C3)O)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2C[NH2+]C[C@H](C3=CC=CC=C3)O)O

InChI

InChI=1S/C19H19NO4/c1-12-16(21)8-7-15-14(9-18(23)24-19(12)15)10-20-11-17(22)13-5-3-2-4-6-13/h2-9,17,20-22H,10-11H2,1H3/p+1/t17-/m1/s1