(2-methylpyrimidin-5-yl)methyl-[(3S)-1-(naphthalen-1-ylmethyl)-5-oxidanylidene-pyrrolidin-3-yl]azanium

Systemtic Name: (2-methylpyrimidin-5-yl)methyl-[(3S)-1-(naphthalen-1-ylmethyl)-5-oxidanylidene-pyrrolidin-3-yl]azanium Openeye Name: (2-methylpyrimidin-5-yl)methyl-[(3S)-1-(1-naphthylmethyl)-5-oxo-pyrrolidin-3-yl]ammonium CAS Name: (2-methyl-5-pyrimidinyl)methyl-[(3S)-1-(1-naphthalenylmethyl)-5-oxo-3-pyrrolidinyl]ammonium IUPAC Name: (2-methylpyrimidin-5-yl)methyl-[(3S)-1-(naphthalen-1-ylmethyl)-5-oxopyrrolidin-3-yl]azanium Traditional Name: [(3S)-5-keto-1-(1-naphthylmethyl)pyrrolidin-3-yl]-[(2-methylpyrimidin-5-yl)methyl]ammonium Formula: C21H23N4O+ MolecularWeight: 347.43352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=N1)C[NH2+]C2CC(=O)N(C2)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC1=NC=C(C=N1)C[NH2+][C@H]2CC(=O)N(C2)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C21H22N4O/c1-15-22-10-16(11-23-15)12-24-19-9-21(26)25(14-19)13-18-7-4-6-17-5-2-3-8-20(17)18/h2-8,10-11,19,24H,9,12-14H2,1H3/p+1/t19-/m0/s1