N-[(1S)-2-imidazol-1-yl-1-phenyl-ethyl]-4-methyl-piperidin-1-ium-4-carboxamide

Systemtic Name: N-[(1S)-2-imidazol-1-yl-1-phenyl-ethyl]-4-methyl-piperidin-1-ium-4-carboxamide Openeye Name: N-[(1S)-2-imidazol-1-yl-1-phenyl-ethyl]-4-methyl-piperidin-1-ium-4-carboxamide CAS Name: N-[(1S)-2-(1-imidazolyl)-1-phenylethyl]-4-methyl-4-piperidin-1-iumcarboxamide IUPAC Name: N-[(1S)-2-imidazol-1-yl-1-phenylethyl]-4-methylpiperidin-1-ium-4-carboxamide Traditional Name: N-[(1S)-2-imidazol-1-yl-1-phenyl-ethyl]-4-methyl-piperidin-1-ium-4-carboxamide Formula: C18H25N4O+ MolecularWeight: 313.4173

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC[NH2+]CC1)C(=O)NC(CN2C=CN=C2)C3=CC=CC=C3

Isomeric SMILES

CC1(CC[NH2+]CC1)C(=O)N[C@H](CN2C=CN=C2)C3=CC=CC=C3

InChI

InChI=1S/C18H24N4O/c1-18(7-9-19-10-8-18)17(23)21-16(13-22-12-11-20-14-22)15-5-3-2-4-6-15/h2-6,11-12,14,16,19H,7-10,13H2,1H3,(H,21,23)/p+1/t16-/m1/s1