(4-dimethylaminophenyl)methyl-[(3S)-3-(4-methoxyphenyl)-4-phenyl-butyl]azanium

Systemtic Name: (4-dimethylaminophenyl)methyl-[(3S)-3-(4-methoxyphenyl)-4-phenyl-butyl]azanium Openeye Name: (4-dimethylaminophenyl)methyl-[(3S)-3-(4-methoxyphenyl)-4-phenyl-butyl]ammonium CAS Name: (4-dimethylaminophenyl)methyl-[(3S)-3-(4-methoxyphenyl)-4-phenylbutyl]ammonium IUPAC Name: (4-dimethylaminophenyl)methyl-[(3S)-3-(4-methoxyphenyl)-4-phenylbutyl]azanium Traditional Name: [4-(dimethylamino)benzyl]-[(3S)-3-(4-methoxyphenyl)-4-phenyl-butyl]ammonium Formula: C26H33N2O+ MolecularWeight: 389.55302

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C[NH2+]CCC(CC2=CC=CC=C2)C3=CC=C(C=C3)OC

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C[NH2+]CC[C@H](CC2=CC=CC=C2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C26H32N2O/c1-28(2)25-13-9-22(10-14-25)20-27-18-17-24(19-21-7-5-4-6-8-21)23-11-15-26(29-3)16-12-23/h4-16,24,27H,17-20H2,1-3H3/p+1/t24-/m1/s1