(2S)-1-[(6-chloranyl-7-ethyl-2-oxidanylidene-chromen-4-yl)methyl]-N,N-dimethyl-pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2S)-1-[(6-chloranyl-7-ethyl-2-oxidanylidene-chromen-4-yl)methyl]-N,N-dimethyl-pyrrolidin-1-ium-2-carboxamide Openeye Name: (2S)-1-[(6-chloro-7-ethyl-2-oxo-chromen-4-yl)methyl]-N,N-dimethyl-pyrrolidin-1-ium-2-carboxamide CAS Name: (2S)-1-[(6-chloro-7-ethyl-2-oxo-1-benzopyran-4-yl)methyl]-N,N-dimethyl-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2S)-1-[(6-chloro-7-ethyl-2-oxochromen-4-yl)methyl]-N,N-dimethylpyrrolidin-1-ium-2-carboxamide Traditional Name: (2S)-1-[(6-chloro-7-ethyl-2-keto-chromen-4-yl)methyl]-N,N-dimethyl-pyrrolidin-1-ium-2-carboxamide Formula: C19H24ClN2O3+ MolecularWeight: 363.85846

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=CC(=O)OC2=C1)C[NH+]3CCCC3C(=O)N(C)C)Cl

Isomeric SMILES

CCC1=C(C=C2C(=CC(=O)OC2=C1)C[NH+]3CCC[C@H]3C(=O)N(C)C)Cl

InChI

InChI=1S/C19H23ClN2O3/c1-4-12-8-17-14(10-15(12)20)13(9-18(23)25-17)11-22-7-5-6-16(22)19(24)21(2)3/h8-10,16H,4-7,11H2,1-3H3/p+1/t16-/m0/s1