diethyl-(2-phenylazanylphenyl)carbonyl-[1-(phenylmethyl)piperidin-3-yl]azanium

Systemtic Name: diethyl-(2-phenylazanylphenyl)carbonyl-[1-(phenylmethyl)piperidin-3-yl]azanium Openeye Name: (2-anilinobenzoyl)-(1-benzyl-3-piperidyl)-diethyl-ammonium CAS Name: [(2-anilinophenyl)-oxomethyl]-diethyl-[1-(phenylmethyl)-3-piperidinyl]ammonium IUPAC Name: (2-anilinobenzoyl)-(1-benzylpiperidin-3-yl)-diethylazanium Traditional Name: (2-anilinobenzoyl)-(1-benzyl-3-piperidyl)-diethyl-ammonium Formula: C29H36N3O+ MolecularWeight: 442.61564

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(C1CCCN(C1)CC2=CC=CC=C2)C(=O)C3=CC=CC=C3NC4=CC=CC=C4

Isomeric SMILES

CC[N+](CC)(C1CCCN(C1)CC2=CC=CC=C2)C(=O)C3=CC=CC=C3NC4=CC=CC=C4

InChI

InChI=1S/C29H35N3O/c1-3-32(4-2,26-18-13-21-31(23-26)22-24-14-7-5-8-15-24)29(33)27-19-11-12-20-28(27)30-25-16-9-6-10-17-25/h5-12,14-17,19-20,26H,3-4,13,18,21-23H2,1-2H3/p+1