cyclopenten-1-yl-[(3S)-3-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)piperidin-1-yl]methanone

Systemtic Name: cyclopenten-1-yl-[(3S)-3-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)piperidin-1-yl]methanone Openeye Name: cyclopenten-1-yl-[(3S)-3-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-1-piperidyl]methanone CAS Name: 1-cyclopentenyl-[(3S)-3-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-1-piperidinyl]methanone IUPAC Name: cyclopenten-1-yl-[(3S)-3-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)piperidin-1-yl]methanone Traditional Name: cyclopenten-1-yl-[(3S)-3-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)piperidino]methanone Formula: C22H31N2O3+ MolecularWeight: 371.49314

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C[NH+](CCC2=C1)C3CCCN(C3)C(=O)C4=CCCC4)OC

Isomeric SMILES

COC1=C(C=C2C[NH+](CCC2=C1)[C@H]3CCCN(C3)C(=O)C4=CCCC4)OC

InChI

InChI=1S/C22H30N2O3/c1-26-20-12-17-9-11-23(14-18(17)13-21(20)27-2)19-8-5-10-24(15-19)22(25)16-6-3-4-7-16/h6,12-13,19H,3-5,7-11,14-15H2,1-2H3/p+1/t19-/m0/s1