[(2R)-1-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methylazaniumyl]-3-phenyl-propan-2-yl]-dimethyl-azanium

Systemtic Name: [(2R)-1-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methylazaniumyl]-3-phenyl-propan-2-yl]-dimethyl-azanium Openeye Name: [(1R)-1-benzyl-2-[(7-methoxy-2-oxo-chromen-4-yl)methylammonio]ethyl]-dimethyl-ammonium CAS Name: [(2R)-1-[(7-methoxy-2-oxo-1-benzopyran-4-yl)methylammonio]-3-phenylpropan-2-yl]-dimethylammonium IUPAC Name: [(2R)-1-[(7-methoxy-2-oxochromen-4-yl)methylazaniumyl]-3-phenylpropan-2-yl]-dimethylazanium Traditional Name: [(1R)-1-benzyl-2-[(2-keto-7-methoxy-chromen-4-yl)methylammonio]ethyl]-dimethyl-ammonium Formula: C22H28N2O3+2 MolecularWeight: 368.46932

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CC1=CC=CC=C1)C[NH2+]CC2=CC(=O)OC3=C2C=CC(=C3)OC

Isomeric SMILES

C[NH+](C)[C@H](CC1=CC=CC=C1)C[NH2+]CC2=CC(=O)OC3=C2C=CC(=C3)OC

InChI

InChI=1S/C22H26N2O3/c1-24(2)18(11-16-7-5-4-6-8-16)15-23-14-17-12-22(25)27-21-13-19(26-3)9-10-20(17)21/h4-10,12-13,18,23H,11,14-15H2,1-3H3/p+2/t18-/m1/s1