3,4,5-trimethoxy-N-[[1-(phenylmethyl)piperidin-1-ium-4-ylidene]amino]benzamide

Systemtic Name: 3,4,5-trimethoxy-N-[[1-(phenylmethyl)piperidin-1-ium-4-ylidene]amino]benzamide Openeye Name: N-[(1-benzylpiperidin-1-ium-4-ylidene)amino]-3,4,5-trimethoxy-benzamide CAS Name: 3,4,5-trimethoxy-N-[[1-(phenylmethyl)-4-piperidin-1-iumylidene]amino]benzamide IUPAC Name: N-[(1-benzylpiperidin-1-ium-4-ylidene)amino]-3,4,5-trimethoxybenzamide Traditional Name: N-[(1-benzylpiperidin-1-ium-4-ylidene)amino]-3,4,5-trimethoxy-benzamide Formula: C22H28N3O4+ MolecularWeight: 398.47542

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NN=C2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NN=C2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O4/c1-27-19-13-17(14-20(28-2)21(19)29-3)22(26)24-23-18-9-11-25(12-10-18)15-16-7-5-4-6-8-16/h4-8,13-14H,9-12,15H2,1-3H3,(H,24,26)/p+1