2-[(phenylmethyl)amino]-3-prop-2-enyl-1,5-dihydroimidazol-3-ium-4-one

Systemtic Name: 2-[(phenylmethyl)amino]-3-prop-2-enyl-1,5-dihydroimidazol-3-ium-4-one Openeye Name: 3-allyl-2-(benzylamino)-1,5-dihydroimidazol-3-ium-4-one CAS Name: 2-[(phenylmethyl)amino]-3-prop-2-enyl-1,5-dihydroimidazol-3-ium-4-one IUPAC Name: 2-(benzylamino)-3-prop-2-enyl-1,5-dihydroimidazol-3-ium-4-one Traditional Name: 3-allyl-2-(benzylamino)-2-imidazolin-3-ium-4-one Formula: C13H16N3O+ MolecularWeight: 230.28564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CC[N+]1=C(NCC1=O)NCC2=CC=CC=C2

Isomeric SMILES

C=CC[N+]1=C(NCC1=O)NCC2=CC=CC=C2

InChI

InChI=1S/C13H15N3O/c1-2-8-16-12(17)10-15-13(16)14-9-11-6-4-3-5-7-11/h2-7H,1,8-10H2,(H,14,15)/p+1