(1S,2R)-2-phenyl-N-[[1-(phenylmethyl)piperidin-1-ium-4-ylidene]amino]cyclopropane-1-carboxamide

Systemtic Name: (1S,2R)-2-phenyl-N-[[1-(phenylmethyl)piperidin-1-ium-4-ylidene]amino]cyclopropane-1-carboxamide Openeye Name: (1S,2R)-N-[(1-benzylpiperidin-1-ium-4-ylidene)amino]-2-phenyl-cyclopropanecarboxamide CAS Name: (1S,2R)-2-phenyl-N-[[1-(phenylmethyl)-4-piperidin-1-iumylidene]amino]-1-cyclopropanecarboxamide IUPAC Name: (1S,2R)-N-[(1-benzylpiperidin-1-ium-4-ylidene)amino]-2-phenylcyclopropane-1-carboxamide Traditional Name: (1S,2R)-N-[(1-benzylpiperidin-1-ium-4-ylidene)amino]-2-phenyl-cyclopropanecarboxamide Formula: C22H26N3O+ MolecularWeight: 348.46134

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1=NNC(=O)C2CC2C3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1=NNC(=O)[C@H]2C[C@H]2C3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C22H25N3O/c26-22(21-15-20(21)18-9-5-2-6-10-18)24-23-19-11-13-25(14-12-19)16-17-7-3-1-4-8-17/h1-10,20-21H,11-16H2,(H,24,26)/p+1/t20-,21-/m0/s1