N-[(2,3-dimethylphenyl)carbamoyl]-2-[(2S)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]ethanamide

Systemtic Name: N-[(2,3-dimethylphenyl)carbamoyl]-2-[(2S)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]ethanamide Openeye Name: N-[(2,3-dimethylphenyl)carbamoyl]-2-[(2S)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]acetamide CAS Name: N-[(2,3-dimethylanilino)-oxomethyl]-2-[(2S)-2-(1-methyl-2-pyrrolyl)-1-pyrrolidin-1-iumyl]acetamide IUPAC Name: N-[(2,3-dimethylphenyl)carbamoyl]-2-[(2S)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]acetamide Traditional Name: N-[(2,3-dimethylphenyl)carbamoyl]-2-[(2S)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]acetamide Formula: C20H27N4O2+ MolecularWeight: 355.45398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)NC(=O)C[NH+]2CCCC2C3=CC=CN3C)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)NC(=O)C[NH+]2CCC[C@H]2C3=CC=CN3C)C

InChI

InChI=1S/C20H26N4O2/c1-14-7-4-8-16(15(14)2)21-20(26)22-19(25)13-24-12-6-10-18(24)17-9-5-11-23(17)3/h4-5,7-9,11,18H,6,10,12-13H2,1-3H3,(H2,21,22,25,26)/p+1/t18-/m0/s1