[1-[4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)butanoyl]piperidin-4-yl]azanium

Systemtic Name: [1-[4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)butanoyl]piperidin-4-yl]azanium Openeye Name: [1-[4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)butanoyl]-4-piperidyl]ammonium CAS Name: [1-[1-oxo-4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)butyl]-4-piperidinyl]ammonium IUPAC Name: [1-[4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)butanoyl]piperidin-4-yl]azanium Traditional Name: [1-[4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)butanoyl]-4-piperidyl]ammonium Formula: C18H29N3O+2 MolecularWeight: 303.44236

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1[NH3+])C(=O)CCC[NH+]2CCC3=CC=CC=C3C2

Isomeric SMILES

C1CN(CCC1[NH3+])C(=O)CCC[NH+]2CCC3=CC=CC=C3C2

InChI

InChI=1S/C18H27N3O/c19-17-8-12-21(13-9-17)18(22)6-3-10-20-11-7-15-4-1-2-5-16(15)14-20/h1-2,4-5,17H,3,6-14,19H2/p+2