(1-methylpiperidin-1-ium-4-yl)-[(3R)-1-(naphthalen-1-ylmethyl)-5-oxidanylidene-pyrrolidin-3-yl]azanium

Systemtic Name: (1-methylpiperidin-1-ium-4-yl)-[(3R)-1-(naphthalen-1-ylmethyl)-5-oxidanylidene-pyrrolidin-3-yl]azanium Openeye Name: (1-methylpiperidin-1-ium-4-yl)-[(3R)-1-(1-naphthylmethyl)-5-oxo-pyrrolidin-3-yl]ammonium CAS Name: (1-methyl-4-piperidin-1-iumyl)-[(3R)-1-(1-naphthalenylmethyl)-5-oxo-3-pyrrolidinyl]ammonium IUPAC Name: (1-methylpiperidin-1-ium-4-yl)-[(3R)-1-(naphthalen-1-ylmethyl)-5-oxopyrrolidin-3-yl]azanium Traditional Name: [(3R)-5-keto-1-(1-naphthylmethyl)pyrrolidin-3-yl]-(1-methylpiperidin-1-ium-4-yl)ammonium Formula: C21H29N3O+2 MolecularWeight: 339.47446

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)[NH2+]C2CC(=O)N(C2)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C[NH+]1CCC(CC1)[NH2+][C@@H]2CC(=O)N(C2)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C21H27N3O/c1-23-11-9-18(10-12-23)22-19-13-21(25)24(15-19)14-17-7-4-6-16-5-2-3-8-20(16)17/h2-8,18-19,22H,9-15H2,1H3/p+2/t19-/m1/s1