[(1S)-2,3-dihydro-1H-inden-1-yl]-[(6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl]azanium

Systemtic Name: [(1S)-2,3-dihydro-1H-inden-1-yl]-[(6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl]azanium Openeye Name: (6-ethyl-7-hydroxy-2-oxo-chromen-4-yl)methyl-[(1S)-indan-1-yl]ammonium CAS Name: [(1S)-2,3-dihydro-1H-inden-1-yl]-[(6-ethyl-7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl]ammonium IUPAC Name: [(1S)-2,3-dihydro-1H-inden-1-yl]-[(6-ethyl-7-hydroxy-2-oxochromen-4-yl)methyl]azanium Traditional Name: (6-ethyl-7-hydroxy-2-keto-chromen-4-yl)methyl-[(1S)-indan-1-yl]ammonium Formula: C21H22NO3+ MolecularWeight: 336.40428

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH2+]C3CCC4=CC=CC=C34)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH2+][C@H]3CCC4=CC=CC=C34)O

InChI

InChI=1S/C21H21NO3/c1-2-13-9-17-15(10-21(24)25-20(17)11-19(13)23)12-22-18-8-7-14-5-3-4-6-16(14)18/h3-6,9-11,18,22-23H,2,7-8,12H2,1H3/p+1/t18-/m0/s1