2-(1H-indol-3-yl)ethyl-[1-[4-(3-phenylpropanoylamino)phenyl]piperidin-4-yl]azanium

Systemtic Name: 2-(1H-indol-3-yl)ethyl-[1-[4-(3-phenylpropanoylamino)phenyl]piperidin-4-yl]azanium Openeye Name: 2-(1H-indol-3-yl)ethyl-[1-[4-(3-phenylpropanoylamino)phenyl]-4-piperidyl]ammonium CAS Name: 2-(1H-indol-3-yl)ethyl-[1-[4-[(1-oxo-3-phenylpropyl)amino]phenyl]-4-piperidinyl]ammonium IUPAC Name: 2-(1H-indol-3-yl)ethyl-[1-[4-(3-phenylpropanoylamino)phenyl]piperidin-4-yl]azanium Traditional Name: [1-[4-(hydrocinnamoylamino)phenyl]-4-piperidyl]-[2-(1H-indol-3-yl)ethyl]ammonium Formula: C30H35N4O+ MolecularWeight: 467.6251

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1[NH2+]CCC2=CNC3=CC=CC=C32)C4=CC=C(C=C4)NC(=O)CCC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1[NH2+]CCC2=CNC3=CC=CC=C32)C4=CC=C(C=C4)NC(=O)CCC5=CC=CC=C5

InChI

InChI=1S/C30H34N4O/c35-30(15-10-23-6-2-1-3-7-23)33-26-11-13-27(14-12-26)34-20-17-25(18-21-34)31-19-16-24-22-32-29-9-5-4-8-28(24)29/h1-9,11-14,22,25,31-32H,10,15-21H2,(H,33,35)/p+1