2-[5-[(phenylmethyl)amino]-3,4-dihydro-2H-pyrrol-1-ium-1-yl]ethanamide

Systemtic Name: 2-[5-[(phenylmethyl)amino]-3,4-dihydro-2H-pyrrol-1-ium-1-yl]ethanamide Openeye Name: 2-[5-(benzylamino)-3,4-dihydro-2H-pyrrol-1-ium-1-yl]acetamide CAS Name: 2-[5-[(phenylmethyl)amino]-3,4-dihydro-2H-pyrrol-1-ium-1-yl]acetamide IUPAC Name: 2-[5-(benzylamino)-3,4-dihydro-2H-pyrrol-1-ium-1-yl]acetamide Traditional Name: 2-[2-(benzylamino)-1-pyrrolin-1-ium-1-yl]acetamide Formula: C13H18N3O+ MolecularWeight: 232.30152

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=[N+](C1)CC(=O)N)NCC2=CC=CC=C2

Isomeric SMILES

C1CC(=[N+](C1)CC(=O)N)NCC2=CC=CC=C2

InChI

InChI=1S/C13H17N3O/c14-12(17)10-16-8-4-7-13(16)15-9-11-5-2-1-3-6-11/h1-3,5-6H,4,7-10H2,(H2,14,17)/p+1