N-[(Z)-[4-[(4-bromophenyl)methoxy]-3-methoxy-phenyl]methylideneamino]-2-piperidin-1-ium-1-yl-ethanamide

Systemtic Name: N-[(Z)-[4-[(4-bromophenyl)methoxy]-3-methoxy-phenyl]methylideneamino]-2-piperidin-1-ium-1-yl-ethanamide Openeye Name: N-[(Z)-[4-[(4-bromophenyl)methoxy]-3-methoxy-phenyl]methyleneamino]-2-piperidin-1-ium-1-yl-acetamide CAS Name: N-[(Z)-[4-[(4-bromophenyl)methoxy]-3-methoxyphenyl]methylideneamino]-2-(1-piperidin-1-iumyl)acetamide IUPAC Name: N-[(Z)-[4-[(4-bromophenyl)methoxy]-3-methoxyphenyl]methylideneamino]-2-piperidin-1-ium-1-ylacetamide Traditional Name: N-[(Z)-[4-(4-bromobenzyl)oxy-3-methoxy-benzylidene]amino]-2-piperidin-1-ium-1-yl-acetamide Formula: C22H27BrN3O3+ MolecularWeight: 461.37208

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NNC(=O)C[NH+]2CCCCC2)OCC3=CC=C(C=C3)Br

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N\NC(=O)C[NH+]2CCCCC2)OCC3=CC=C(C=C3)Br

InChI

InChI=1S/C22H26BrN3O3/c1-28-21-13-18(14-24-25-22(27)15-26-11-3-2-4-12-26)7-10-20(21)29-16-17-5-8-19(23)9-6-17/h5-10,13-14H,2-4,11-12,15-16H2,1H3,(H,25,27)/p+1/b24-14-