[(4R,5R)-2-azanyl-4-phenyl-4,5-dihydro-1H-imidazol-3-ium-5-yl]-phenyl-methanone

Systemtic Name: [(4R,5R)-2-azanyl-4-phenyl-4,5-dihydro-1H-imidazol-3-ium-5-yl]-phenyl-methanone Openeye Name: [(4R,5R)-2-amino-4-phenyl-4,5-dihydro-1H-imidazol-3-ium-5-yl]-phenyl-methanone CAS Name: [(4R,5R)-2-amino-4-phenyl-4,5-dihydro-1H-imidazol-3-ium-5-yl]-phenylmethanone IUPAC Name: [(4R,5R)-2-amino-4-phenyl-4,5-dihydro-1H-imidazol-3-ium-5-yl]-phenylmethanone Traditional Name: [(4R,5R)-2-amino-5-phenyl-2-imidazolin-1-ium-4-yl]-phenyl-methanone Formula: C16H16N3O+ MolecularWeight: 266.31774

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C(NC(=[NH+]2)N)C(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)[C@@H]2[C@@H](NC(=[NH+]2)N)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C16H15N3O/c17-16-18-13(11-7-3-1-4-8-11)14(19-16)15(20)12-9-5-2-6-10-12/h1-10,13-14H,(H3,17,18,19)/p+1/t13-,14-/m1/s1