[4-[[[1-[(3-cyanophenyl)methyl]indol-3-yl]carbonylamino]methyl]phenyl]-trimethyl-azanium

Systemtic Name: [4-[[[1-[(3-cyanophenyl)methyl]indol-3-yl]carbonylamino]methyl]phenyl]-trimethyl-azanium Openeye Name: [4-[[[1-[(3-cyanophenyl)methyl]indole-3-carbonyl]amino]methyl]phenyl]-trimethyl-ammonium CAS Name: [4-[[[[1-[(3-cyanophenyl)methyl]-3-indolyl]-oxomethyl]amino]methyl]phenyl]-trimethylammonium IUPAC Name: [4-[[[1-[(3-cyanophenyl)methyl]indole-3-carbonyl]amino]methyl]phenyl]-trimethylazanium Traditional Name: [4-[[[1-(3-cyanobenzyl)indole-3-carbonyl]amino]methyl]phenyl]-trimethyl-ammonium Formula: C27H27N4O+ MolecularWeight: 423.52948

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C1=CC=C(C=C1)CNC(=O)C2=CN(C3=CC=CC=C32)CC4=CC=CC(=C4)C#N

Isomeric SMILES

C[N+](C)(C)C1=CC=C(C=C1)CNC(=O)C2=CN(C3=CC=CC=C32)CC4=CC=CC(=C4)C#N

InChI

InChI=1S/C27H26N4O/c1-31(2,3)23-13-11-20(12-14-23)17-29-27(32)25-19-30(26-10-5-4-9-24(25)26)18-22-8-6-7-21(15-22)16-28/h4-15,19H,17-18H2,1-3H3/p+1