N-(2,2-diphenylethyl)-4-(2-piperidin-1-ium-1-ylethyl)aniline

Systemtic Name: N-(2,2-diphenylethyl)-4-(2-piperidin-1-ium-1-ylethyl)aniline Openeye Name: N-(2,2-diphenylethyl)-4-(2-piperidin-1-ium-1-ylethyl)aniline CAS Name: N-(2,2-diphenylethyl)-4-[2-(1-piperidin-1-iumyl)ethyl]aniline IUPAC Name: N-(2,2-diphenylethyl)-4-(2-piperidin-1-ium-1-ylethyl)aniline Traditional Name: 2,2-diphenylethyl-[4-(2-piperidin-1-ium-1-ylethyl)phenyl]amine Formula: C27H33N2+ MolecularWeight: 385.56432

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCC2=CC=C(C=C2)NCC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CC[NH+](CC1)CCC2=CC=C(C=C2)NCC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H32N2/c1-4-10-24(11-5-1)27(25-12-6-2-7-13-25)22-28-26-16-14-23(15-17-26)18-21-29-19-8-3-9-20-29/h1-2,4-7,10-17,27-28H,3,8-9,18-22H2/p+1