methyl-[(3S)-1-(4-phenylbutanoyl)piperidin-3-yl]-(phenylmethyl)azanium

Systemtic Name: methyl-[(3S)-1-(4-phenylbutanoyl)piperidin-3-yl]-(phenylmethyl)azanium Openeye Name: benzyl-methyl-[(3S)-1-(4-phenylbutanoyl)-3-piperidyl]ammonium CAS Name: methyl-[(3S)-1-(1-oxo-4-phenylbutyl)-3-piperidinyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-methyl-[(3S)-1-(4-phenylbutanoyl)piperidin-3-yl]azanium Traditional Name: benzyl-methyl-[(3S)-1-(4-phenylbutanoyl)-3-piperidyl]ammonium Formula: C23H31N2O+ MolecularWeight: 351.50504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)C2CCCN(C2)C(=O)CCCC3=CC=CC=C3

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)[C@H]2CCCN(C2)C(=O)CCCC3=CC=CC=C3

InChI

InChI=1S/C23H30N2O/c1-24(18-21-12-6-3-7-13-21)22-15-9-17-25(19-22)23(26)16-8-14-20-10-4-2-5-11-20/h2-7,10-13,22H,8-9,14-19H2,1H3/p+1/t22-/m0/s1