cyclopenten-1-yl-[(3S)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)piperidin-1-yl]methanone

Systemtic Name: cyclopenten-1-yl-[(3S)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)piperidin-1-yl]methanone Openeye Name: cyclopenten-1-yl-[(3S)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-1-piperidyl]methanone CAS Name: 1-cyclopentenyl-[(3S)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-1-piperidinyl]methanone IUPAC Name: cyclopenten-1-yl-[(3S)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)piperidin-1-yl]methanone Traditional Name: cyclopenten-1-yl-[(3S)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)piperidino]methanone Formula: C20H27N2O+ MolecularWeight: 311.44118

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Descriptors Computed from Structure

Canonical SMILES:

C1CC=C(C1)C(=O)N2CCCC(C2)[NH+]3CCC4=CC=CC=C4C3

Isomeric SMILES

C1CC=C(C1)C(=O)N2CCC[C@@H](C2)[NH+]3CCC4=CC=CC=C4C3

InChI

InChI=1S/C20H26N2O/c23-20(17-7-2-3-8-17)22-12-5-10-19(15-22)21-13-11-16-6-1-4-9-18(16)14-21/h1,4,6-7,9,19H,2-3,5,8,10-15H2/p+1/t19-/m0/s1