(1-ethyl-5-methyl-pyrazol-4-yl)methyl-[(3R)-1-(naphthalen-1-ylmethyl)-5-oxidanylidene-pyrrolidin-3-yl]azanium

Systemtic Name: (1-ethyl-5-methyl-pyrazol-4-yl)methyl-[(3R)-1-(naphthalen-1-ylmethyl)-5-oxidanylidene-pyrrolidin-3-yl]azanium Openeye Name: (1-ethyl-5-methyl-pyrazol-4-yl)methyl-[(3R)-1-(1-naphthylmethyl)-5-oxo-pyrrolidin-3-yl]ammonium CAS Name: (1-ethyl-5-methyl-4-pyrazolyl)methyl-[(3R)-1-(1-naphthalenylmethyl)-5-oxo-3-pyrrolidinyl]ammonium IUPAC Name: (1-ethyl-5-methylpyrazol-4-yl)methyl-[(3R)-1-(naphthalen-1-ylmethyl)-5-oxopyrrolidin-3-yl]azanium Traditional Name: (1-ethyl-5-methyl-pyrazol-4-yl)methyl-[(3R)-5-keto-1-(1-naphthylmethyl)pyrrolidin-3-yl]ammonium Formula: C22H27N4O+ MolecularWeight: 363.47598

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)C[NH2+]C2CC(=O)N(C2)CC3=CC=CC4=CC=CC=C43)C

Isomeric SMILES

CCN1C(=C(C=N1)C[NH2+][C@@H]2CC(=O)N(C2)CC3=CC=CC4=CC=CC=C43)C

InChI

InChI=1S/C22H26N4O/c1-3-26-16(2)19(13-24-26)12-23-20-11-22(27)25(15-20)14-18-9-6-8-17-7-4-5-10-21(17)18/h4-10,13,20,23H,3,11-12,14-15H2,1-2H3/p+1/t20-/m1/s1