2-methoxyethyl (4R)-2,6-dimethyl-4-(3-nitrophenyl)-3-propyl-3,4-dihydropyridin-1-ium-5-carboxylate

Systemtic Name: 2-methoxyethyl (4R)-2,6-dimethyl-4-(3-nitrophenyl)-3-propyl-3,4-dihydropyridin-1-ium-5-carboxylate Openeye Name: 2-methoxyethyl (4R)-2,6-dimethyl-4-(3-nitrophenyl)-3-propyl-3,4-dihydropyridin-1-ium-5-carboxylate CAS Name: (4R)-2,6-dimethyl-4-(3-nitrophenyl)-3-propyl-3,4-dihydropyridin-1-ium-5-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (4R)-2,6-dimethyl-4-(3-nitrophenyl)-3-propyl-3,4-dihydropyridin-1-ium-5-carboxylate Traditional Name: (4R)-2,6-dimethyl-4-(3-nitrophenyl)-3-propyl-3,4-dihydropyridin-1-ium-5-carboxylic acid 2-methoxyethyl ester Formula: C20H27N2O5+ MolecularWeight: 375.43878

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(C(=C([NH+]=C1C)C)C(=O)OCCOC)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCCC1[C@@H](C(=C([NH+]=C1C)C)C(=O)OCCOC)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H26N2O5/c1-5-7-17-13(2)21-14(3)18(20(23)27-11-10-26-4)19(17)15-8-6-9-16(12-15)22(24)25/h6,8-9,12,17,19H,5,7,10-11H2,1-4H3/p+1/t17?,19-/m0/s1