(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]azanium

Systemtic Name: (7-methoxy-2-oxidanylidene-chromen-4-yl)methyl-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]azanium Openeye Name: (7-methoxy-2-oxo-chromen-4-yl)methyl-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]ammonium CAS Name: (7-methoxy-2-oxo-1-benzopyran-4-yl)methyl-[(2R)-2-(4-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]ammonium IUPAC Name: (7-methoxy-2-oxochromen-4-yl)methyl-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]azanium Traditional Name: (2-keto-7-methoxy-chromen-4-yl)methyl-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]ammonium Formula: C24H30N2O4+2 MolecularWeight: 410.506

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C[NH2+]CC2=CC(=O)OC3=C2C=CC(=C3)OC)[NH+]4CCCC4

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](C[NH2+]CC2=CC(=O)OC3=C2C=CC(=C3)OC)[NH+]4CCCC4

InChI

InChI=1S/C24H28N2O4/c1-28-19-7-5-17(6-8-19)22(26-11-3-4-12-26)16-25-15-18-13-24(27)30-23-14-20(29-2)9-10-21(18)23/h5-10,13-14,22,25H,3-4,11-12,15-16H2,1-2H3/p+2/t22-/m0/s1