(2S)-1-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl]-N,N-dimethyl-pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2S)-1-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl]-N,N-dimethyl-pyrrolidin-1-ium-2-carboxamide Openeye Name: (2S)-1-[(7-methoxy-2-oxo-chromen-4-yl)methyl]-N,N-dimethyl-pyrrolidin-1-ium-2-carboxamide CAS Name: (2S)-1-[(7-methoxy-2-oxo-1-benzopyran-4-yl)methyl]-N,N-dimethyl-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2S)-1-[(7-methoxy-2-oxochromen-4-yl)methyl]-N,N-dimethylpyrrolidin-1-ium-2-carboxamide Traditional Name: (2S)-1-[(2-keto-7-methoxy-chromen-4-yl)methyl]-N,N-dimethyl-pyrrolidin-1-ium-2-carboxamide Formula: C18H23N2O4+ MolecularWeight: 331.38622

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1CCC[NH+]1CC2=CC(=O)OC3=C2C=CC(=C3)OC

Isomeric SMILES

CN(C)C(=O)[C@@H]1CCC[NH+]1CC2=CC(=O)OC3=C2C=CC(=C3)OC

InChI

InChI=1S/C18H22N2O4/c1-19(2)18(22)15-5-4-8-20(15)11-12-9-17(21)24-16-10-13(23-3)6-7-14(12)16/h6-7,9-10,15H,4-5,8,11H2,1-3H3/p+1/t15-/m0/s1