2-indol-1-ylethyl-[1-[4-(2-phenoxyethanoylamino)phenyl]piperidin-4-yl]azanium

Systemtic Name: 2-indol-1-ylethyl-[1-[4-(2-phenoxyethanoylamino)phenyl]piperidin-4-yl]azanium Openeye Name: 2-indol-1-ylethyl-[1-[4-[(2-phenoxyacetyl)amino]phenyl]-4-piperidyl]ammonium CAS Name: 2-(1-indolyl)ethyl-[1-[4-[(1-oxo-2-phenoxyethyl)amino]phenyl]-4-piperidinyl]ammonium IUPAC Name: 2-indol-1-ylethyl-[1-[4-[(2-phenoxyacetyl)amino]phenyl]piperidin-4-yl]azanium Traditional Name: 2-indol-1-ylethyl-[1-[4-[(2-phenoxyacetyl)amino]phenyl]-4-piperidyl]ammonium Formula: C29H33N4O2+ MolecularWeight: 469.59792

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1[NH2+]CCN2C=CC3=CC=CC=C32)C4=CC=C(C=C4)NC(=O)COC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1[NH2+]CCN2C=CC3=CC=CC=C32)C4=CC=C(C=C4)NC(=O)COC5=CC=CC=C5

InChI

InChI=1S/C29H32N4O2/c34-29(22-35-27-7-2-1-3-8-27)31-25-10-12-26(13-11-25)32-19-15-24(16-20-32)30-17-21-33-18-14-23-6-4-5-9-28(23)33/h1-14,18,24,30H,15-17,19-22H2,(H,31,34)/p+1