[(1S)-2-[(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methylazaniumyl]-1-phenyl-ethyl]-diethyl-azanium

Systemtic Name: [(1S)-2-[(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methylazaniumyl]-1-phenyl-ethyl]-diethyl-azanium Openeye Name: [(1S)-2-[(6,7-dimethyl-2-oxo-chromen-4-yl)methylammonio]-1-phenyl-ethyl]-diethyl-ammonium CAS Name: [(1S)-2-[(6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methylammonio]-1-phenylethyl]-diethylammonium IUPAC Name: [(1S)-2-[(6,7-dimethyl-2-oxochromen-4-yl)methylazaniumyl]-1-phenylethyl]-diethylazanium Traditional Name: diethyl-[(1S)-2-[(2-keto-6,7-dimethyl-chromen-4-yl)methylammonio]-1-phenyl-ethyl]ammonium Formula: C24H32N2O2+2 MolecularWeight: 380.52308

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(C[NH2+]CC1=CC(=O)OC2=CC(=C(C=C12)C)C)C3=CC=CC=C3

Isomeric SMILES

CC[NH+](CC)[C@H](C[NH2+]CC1=CC(=O)OC2=CC(=C(C=C12)C)C)C3=CC=CC=C3

InChI

InChI=1S/C24H30N2O2/c1-5-26(6-2)22(19-10-8-7-9-11-19)16-25-15-20-14-24(27)28-23-13-18(4)17(3)12-21(20)23/h7-14,22,25H,5-6,15-16H2,1-4H3/p+2/t22-/m1/s1