1H-indol-2-ylmethyl-[1-[4-(pyridin-3-ylmethylcarbamoyl)phenyl]piperidin-4-yl]azanium

Systemtic Name: 1H-indol-2-ylmethyl-[1-[4-(pyridin-3-ylmethylcarbamoyl)phenyl]piperidin-4-yl]azanium Openeye Name: 1H-indol-2-ylmethyl-[1-[4-(3-pyridylmethylcarbamoyl)phenyl]-4-piperidyl]ammonium CAS Name: 1H-indol-2-ylmethyl-[1-[4-[oxo-(3-pyridinylmethylamino)methyl]phenyl]-4-piperidinyl]ammonium IUPAC Name: 1H-indol-2-ylmethyl-[1-[4-(pyridin-3-ylmethylcarbamoyl)phenyl]piperidin-4-yl]azanium Traditional Name: 1H-indol-2-ylmethyl-[1-[4-(3-pyridylmethylcarbamoyl)phenyl]-4-piperidyl]ammonium Formula: C27H30N5O+ MolecularWeight: 440.56

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1[NH2+]CC2=CC3=CC=CC=C3N2)C4=CC=C(C=C4)C(=O)NCC5=CN=CC=C5

Isomeric SMILES

C1CN(CCC1[NH2+]CC2=CC3=CC=CC=C3N2)C4=CC=C(C=C4)C(=O)NCC5=CN=CC=C5

InChI

InChI=1S/C27H29N5O/c33-27(30-18-20-4-3-13-28-17-20)21-7-9-25(10-8-21)32-14-11-23(12-15-32)29-19-24-16-22-5-1-2-6-26(22)31-24/h1-10,13,16-17,23,29,31H,11-12,14-15,18-19H2,(H,30,33)/p+1