(2,3-dimethylimidazol-4-yl)methyl-[(3R)-5-oxidanylidene-1-(3-phenylpropyl)pyrrolidin-3-yl]azanium

Systemtic Name: (2,3-dimethylimidazol-4-yl)methyl-[(3R)-5-oxidanylidene-1-(3-phenylpropyl)pyrrolidin-3-yl]azanium Openeye Name: (2,3-dimethylimidazol-4-yl)methyl-[(3R)-5-oxo-1-(3-phenylpropyl)pyrrolidin-3-yl]ammonium CAS Name: (2,3-dimethyl-4-imidazolyl)methyl-[(3R)-5-oxo-1-(3-phenylpropyl)-3-pyrrolidinyl]ammonium IUPAC Name: (2,3-dimethylimidazol-4-yl)methyl-[(3R)-5-oxo-1-(3-phenylpropyl)pyrrolidin-3-yl]azanium Traditional Name: (2,3-dimethylimidazol-4-yl)methyl-[(3R)-5-keto-1-(3-phenylpropyl)pyrrolidin-3-yl]ammonium Formula: C19H27N4O+ MolecularWeight: 327.44388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1C)C[NH2+]C2CC(=O)N(C2)CCCC3=CC=CC=C3

Isomeric SMILES

CC1=NC=C(N1C)C[NH2+][C@@H]2CC(=O)N(C2)CCCC3=CC=CC=C3

InChI

InChI=1S/C19H26N4O/c1-15-20-12-18(22(15)2)13-21-17-11-19(24)23(14-17)10-6-9-16-7-4-3-5-8-16/h3-5,7-8,12,17,21H,6,9-11,13-14H2,1-2H3/p+1/t17-/m1/s1