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

Systemtic Name: 2-(azocan-1-ium-1-yl)-N-[(Z)-(4-methoxy-3-methyl-phenyl)methylideneamino]ethanamide Openeye Name: 2-(azocan-1-ium-1-yl)-N-[(Z)-(4-methoxy-3-methyl-phenyl)methyleneamino]acetamide CAS Name: 2-(1-azocan-1-iumyl)-N-[(Z)-(4-methoxy-3-methylphenyl)methylideneamino]acetamide IUPAC Name: 2-(azocan-1-ium-1-yl)-N-[(Z)-(4-methoxy-3-methylphenyl)methylideneamino]acetamide Traditional Name: 2-(azocan-1-ium-1-yl)-N-[(Z)-(4-methoxy-3-methyl-benzylidene)amino]acetamide Formula: C18H28N3O2+ MolecularWeight: 318.43382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C=NNC(=O)C[NH+]2CCCCCCC2)OC

Isomeric SMILES

CC1=C(C=CC(=C1)/C=N\NC(=O)C[NH+]2CCCCCCC2)OC

InChI

InChI=1S/C18H27N3O2/c1-15-12-16(8-9-17(15)23-2)13-19-20-18(22)14-21-10-6-4-3-5-7-11-21/h8-9,12-13H,3-7,10-11,14H2,1-2H3,(H,20,22)/p+1/b19-13-