(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-(phenylmethyl)-propan-2-yl-azanium

Systemtic Name: (7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-(phenylmethyl)-propan-2-yl-azanium Openeye Name: benzyl-[(7,8-dimethyl-2-oxo-chromen-4-yl)methyl]-isopropyl-ammonium CAS Name: (7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl-(phenylmethyl)-propan-2-ylammonium IUPAC Name: benzyl-[(7,8-dimethyl-2-oxochromen-4-yl)methyl]-propan-2-ylazanium Traditional Name: benzyl-isopropyl-[(2-keto-7,8-dimethyl-chromen-4-yl)methyl]ammonium Formula: C22H26NO2+ MolecularWeight: 336.44734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)C[NH+](CC3=CC=CC=C3)C(C)C)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)C[NH+](CC3=CC=CC=C3)C(C)C)C

InChI

InChI=1S/C22H25NO2/c1-15(2)23(13-18-8-6-5-7-9-18)14-19-12-21(24)25-22-17(4)16(3)10-11-20(19)22/h5-12,15H,13-14H2,1-4H3/p+1