N-[4-(3,4-dihydro-2H-pyrrol-1-ium-5-ylamino)phenyl]ethanamide

Systemtic Name: N-[4-(3,4-dihydro-2H-pyrrol-1-ium-5-ylamino)phenyl]ethanamide Openeye Name: N-[4-(3,4-dihydro-2H-pyrrol-1-ium-5-ylamino)phenyl]acetamide CAS Name: N-[4-(3,4-dihydro-2H-pyrrol-1-ium-5-ylamino)phenyl]acetamide IUPAC Name: N-[4-(3,4-dihydro-2H-pyrrol-1-ium-5-ylamino)phenyl]acetamide Traditional Name: N-[4-(1-pyrrolin-1-ium-2-ylamino)phenyl]acetamide Formula: C12H16N3O+ MolecularWeight: 218.27494

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC2=[NH+]CCC2

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC2=[NH+]CCC2

InChI

InChI=1S/C12H15N3O/c1-9(16)14-10-4-6-11(7-5-10)15-12-3-2-8-13-12/h4-7H,2-3,8H2,1H3,(H,13,15)(H,14,16)/p+1