[(3S)-1-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)piperidin-3-yl]-methyl-phenethyl-azanium

Systemtic Name: [(3S)-1-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)piperidin-3-yl]-methyl-phenethyl-azanium Openeye Name: [(3S)-1-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)-3-piperidyl]-methyl-phenethyl-ammonium CAS Name: [(3S)-1-[3-(2-imidazo[1,2-a]pyridinyl)-1-oxopropyl]-3-piperidinyl]-methyl-phenethylammonium IUPAC Name: [(3S)-1-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)piperidin-3-yl]-methyl-phenethylazanium Traditional Name: [(3S)-1-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)-3-piperidyl]-methyl-phenethyl-ammonium Formula: C24H31N4O+ MolecularWeight: 391.52914

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1=CC=CC=C1)C2CCCN(C2)C(=O)CCC3=CN4C=CC=CC4=N3

Isomeric SMILES

C[NH+](CCC1=CC=CC=C1)[C@H]2CCCN(C2)C(=O)CCC3=CN4C=CC=CC4=N3

InChI

InChI=1S/C24H30N4O/c1-26(17-14-20-8-3-2-4-9-20)22-10-7-16-28(19-22)24(29)13-12-21-18-27-15-6-5-11-23(27)25-21/h2-6,8-9,11,15,18,22H,7,10,12-14,16-17,19H2,1H3/p+1/t22-/m0/s1