[(1S)-2-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methylazaniumyl]-1-(4-methoxyphenyl)ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methylazaniumyl]-1-(4-methoxyphenyl)ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[(7-methoxy-2-oxo-chromen-4-yl)methylammonio]-1-(4-methoxyphenyl)ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[(7-methoxy-2-oxo-1-benzopyran-4-yl)methylammonio]-1-(4-methoxyphenyl)ethyl]-dimethylammonium IUPAC Name: [(1S)-2-[(7-methoxy-2-oxochromen-4-yl)methylazaniumyl]-1-(4-methoxyphenyl)ethyl]-dimethylazanium Traditional Name: [(1S)-2-[(2-keto-7-methoxy-chromen-4-yl)methylammonio]-1-(4-methoxyphenyl)ethyl]-dimethyl-ammonium Formula: C22H28N2O4+2 MolecularWeight: 384.46872

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(C[NH2+]CC1=CC(=O)OC2=C1C=CC(=C2)OC)C3=CC=C(C=C3)OC

Isomeric SMILES

C[NH+](C)[C@H](C[NH2+]CC1=CC(=O)OC2=C1C=CC(=C2)OC)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H26N2O4/c1-24(2)20(15-5-7-17(26-3)8-6-15)14-23-13-16-11-22(25)28-21-12-18(27-4)9-10-19(16)21/h5-12,20,23H,13-14H2,1-4H3/p+2/t20-/m1/s1