2-(benzotriazol-1-yl)-N-[(Z)-1-[4-methoxy-3-(piperidin-1-ium-1-ylmethyl)phenyl]ethylideneamino]ethanamide

Systemtic Name: 2-(benzotriazol-1-yl)-N-[(Z)-1-[4-methoxy-3-(piperidin-1-ium-1-ylmethyl)phenyl]ethylideneamino]ethanamide Openeye Name: 2-(benzotriazol-1-yl)-N-[(Z)-1-[4-methoxy-3-(piperidin-1-ium-1-ylmethyl)phenyl]ethylideneamino]acetamide CAS Name: 2-(1-benzotriazolyl)-N-[(Z)-1-[4-methoxy-3-(1-piperidin-1-iumylmethyl)phenyl]ethylideneamino]acetamide IUPAC Name: 2-(benzotriazol-1-yl)-N-[(Z)-1-[4-methoxy-3-(piperidin-1-ium-1-ylmethyl)phenyl]ethylideneamino]acetamide Traditional Name: 2-(benzotriazol-1-yl)-N-[(Z)-1-[4-methoxy-3-(piperidin-1-ium-1-ylmethyl)phenyl]ethylideneamino]acetamide Formula: C23H29N6O2+ MolecularWeight: 421.51536

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)CN1C2=CC=CC=C2N=N1)C3=CC(=C(C=C3)OC)C[NH+]4CCCCC4

Isomeric SMILES

C/C(=N/NC(=O)CN1C2=CC=CC=C2N=N1)/C3=CC(=C(C=C3)OC)C[NH+]4CCCCC4

InChI

InChI=1S/C23H28N6O2/c1-17(24-26-23(30)16-29-21-9-5-4-8-20(21)25-27-29)18-10-11-22(31-2)19(14-18)15-28-12-6-3-7-13-28/h4-5,8-11,14H,3,6-7,12-13,15-16H2,1-2H3,(H,26,30)/p+1/b24-17-