N-[(Z)-1-[4-methoxy-3-(piperidin-1-ium-1-ylmethyl)phenyl]ethylideneamino]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[(Z)-1-[4-methoxy-3-(piperidin-1-ium-1-ylmethyl)phenyl]ethylideneamino]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[(Z)-1-[4-methoxy-3-(piperidin-1-ium-1-ylmethyl)phenyl]ethylideneamino]-1,3-benzodioxole-5-carboxamide CAS Name: N-[(Z)-1-[4-methoxy-3-(1-piperidin-1-iumylmethyl)phenyl]ethylideneamino]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[(Z)-1-[4-methoxy-3-(piperidin-1-ium-1-ylmethyl)phenyl]ethylideneamino]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[(Z)-1-[4-methoxy-3-(piperidin-1-ium-1-ylmethyl)phenyl]ethylideneamino]-piperonylamide Formula: C23H28N3O4+ MolecularWeight: 410.48612

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC2=C(C=C1)OCO2)C3=CC(=C(C=C3)OC)C[NH+]4CCCCC4

Isomeric SMILES

C/C(=N/NC(=O)C1=CC2=C(C=C1)OCO2)/C3=CC(=C(C=C3)OC)C[NH+]4CCCCC4

InChI

InChI=1S/C23H27N3O4/c1-16(24-25-23(27)18-7-9-21-22(13-18)30-15-29-21)17-6-8-20(28-2)19(12-17)14-26-10-4-3-5-11-26/h6-9,12-13H,3-5,10-11,14-15H2,1-2H3,(H,25,27)/p+1/b24-16-