[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-[(1R)-1-(4-imidazol-1-ylphenyl)ethyl]azanium

Systemtic Name: [2-(cyclopropylamino)-2-oxidanylidene-ethyl]-[(1R)-1-(4-imidazol-1-ylphenyl)ethyl]azanium Openeye Name: [2-(cyclopropylamino)-2-oxo-ethyl]-[(1R)-1-(4-imidazol-1-ylphenyl)ethyl]ammonium CAS Name: [2-(cyclopropylamino)-2-oxoethyl]-[(1R)-1-[4-(1-imidazolyl)phenyl]ethyl]ammonium IUPAC Name: [2-(cyclopropylamino)-2-oxoethyl]-[(1R)-1-(4-imidazol-1-ylphenyl)ethyl]azanium Traditional Name: [2-(cyclopropylamino)-2-keto-ethyl]-[(1R)-1-(4-imidazol-1-ylphenyl)ethyl]ammonium Formula: C16H21N4O+ MolecularWeight: 285.36414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2C=CN=C2)[NH2+]CC(=O)NC3CC3

Isomeric SMILES

C[C@H](C1=CC=C(C=C1)N2C=CN=C2)[NH2+]CC(=O)NC3CC3

InChI

InChI=1S/C16H20N4O/c1-12(18-10-16(21)19-14-4-5-14)13-2-6-15(7-3-13)20-9-8-17-11-20/h2-3,6-9,11-12,14,18H,4-5,10H2,1H3,(H,19,21)/p+1/t12-/m1/s1