[1-[4-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]piperidin-4-yl]-(2-indol-1-ylethyl)azanium

Systemtic Name: [1-[4-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]piperidin-4-yl]-(2-indol-1-ylethyl)azanium Openeye Name: [1-[4-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-4-piperidyl]-(2-indol-1-ylethyl)ammonium CAS Name: [1-[4-[(1,3-benzodioxol-5-ylmethylamino)-oxomethyl]phenyl]-4-piperidinyl]-[2-(1-indolyl)ethyl]ammonium IUPAC Name: [1-[4-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]piperidin-4-yl]-(2-indol-1-ylethyl)azanium Traditional Name: 2-indol-1-ylethyl-[1-[4-(piperonylcarbamoyl)phenyl]-4-piperidyl]ammonium Formula: C30H33N4O3+ MolecularWeight: 497.60802

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1[NH2+]CCN2C=CC3=CC=CC=C32)C4=CC=C(C=C4)C(=O)NCC5=CC6=C(C=C5)OCO6

Isomeric SMILES

C1CN(CCC1[NH2+]CCN2C=CC3=CC=CC=C32)C4=CC=C(C=C4)C(=O)NCC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C30H32N4O3/c35-30(32-20-22-5-10-28-29(19-22)37-21-36-28)24-6-8-26(9-7-24)33-16-12-25(13-17-33)31-14-18-34-15-11-23-3-1-2-4-27(23)34/h1-11,15,19,25,31H,12-14,16-18,20-21H2,(H,32,35)/p+1