(2R)-2-[(2R)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]-N-(2-nitrophenyl)propanamide

Systemtic Name: (2R)-2-[(2R)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]-N-(2-nitrophenyl)propanamide Openeye Name: (2R)-2-[(2R)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]-N-(2-nitrophenyl)propanamide CAS Name: (2R)-2-[(2R)-2-(1-methyl-2-pyrrolyl)-1-pyrrolidin-1-iumyl]-N-(2-nitrophenyl)propanamide IUPAC Name: (2R)-2-[(2R)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]-N-(2-nitrophenyl)propanamide Traditional Name: (2R)-2-[(2R)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]-N-(2-nitrophenyl)propionamide Formula: C18H23N4O3+ MolecularWeight: 343.40022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1[N+](=O)[O-])[NH+]2CCCC2C3=CC=CN3C

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1[N+](=O)[O-])[NH+]2CCC[C@@H]2C3=CC=CN3C

InChI

InChI=1S/C18H22N4O3/c1-13(18(23)19-14-7-3-4-8-15(14)22(24)25)21-12-6-10-17(21)16-9-5-11-20(16)2/h3-5,7-9,11,13,17H,6,10,12H2,1-2H3,(H,19,23)/p+1/t13-,17-/m1/s1