[1-(3-chlorophenyl)carbonylpiperidin-4-yl]-phenethyl-(phenylmethyl)azanium

Systemtic Name: [1-(3-chlorophenyl)carbonylpiperidin-4-yl]-phenethyl-(phenylmethyl)azanium Openeye Name: benzyl-[1-(3-chlorobenzoyl)-4-piperidyl]-phenethyl-ammonium CAS Name: [1-[(3-chlorophenyl)-oxomethyl]-4-piperidinyl]-phenethyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[1-(3-chlorobenzoyl)piperidin-4-yl]-phenethylazanium Traditional Name: benzyl-[1-(3-chlorobenzoyl)-4-piperidyl]-phenethyl-ammonium Formula: C27H30ClN2O+ MolecularWeight: 433.9929

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1[NH+](CCC2=CC=CC=C2)CC3=CC=CC=C3)C(=O)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1CN(CCC1[NH+](CCC2=CC=CC=C2)CC3=CC=CC=C3)C(=O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C27H29ClN2O/c28-25-13-7-12-24(20-25)27(31)29-18-15-26(16-19-29)30(21-23-10-5-2-6-11-23)17-14-22-8-3-1-4-9-22/h1-13,20,26H,14-19,21H2/p+1