(3-methoxy-5,6,7,8-tetrahydronaphthalen-2-yl)methyl-(pyridin-3-ylmethyl)-(thiophen-2-ylmethyl)azanium

Systemtic Name: (3-methoxy-5,6,7,8-tetrahydronaphthalen-2-yl)methyl-(pyridin-3-ylmethyl)-(thiophen-2-ylmethyl)azanium Openeye Name: (7-methoxytetralin-6-yl)methyl-(3-pyridylmethyl)-(2-thienylmethyl)ammonium CAS Name: (3-methoxy-5,6,7,8-tetrahydronaphthalen-2-yl)methyl-(3-pyridinylmethyl)-(thiophen-2-ylmethyl)ammonium IUPAC Name: (3-methoxy-5,6,7,8-tetrahydronaphthalen-2-yl)methyl-(pyridin-3-ylmethyl)-(thiophen-2-ylmethyl)azanium Traditional Name: (7-methoxytetralin-6-yl)methyl-(3-pyridylmethyl)-(2-thenyl)ammonium Formula: C23H27N2OS+ MolecularWeight: 379.53828

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CCCCC2=C1)C[NH+](CC3=CN=CC=C3)CC4=CC=CS4

Isomeric SMILES

COC1=C(C=C2CCCCC2=C1)C[NH+](CC3=CN=CC=C3)CC4=CC=CS4

InChI

InChI=1S/C23H26N2OS/c1-26-23-13-20-8-3-2-7-19(20)12-21(23)16-25(17-22-9-5-11-27-22)15-18-6-4-10-24-14-18/h4-6,9-14H,2-3,7-8,15-17H2,1H3/p+1