4-ethoxy-N-(phenylmethyl)-N-pyridin-1-ium-2-yl-benzamide

Systemtic Name: 4-ethoxy-N-(phenylmethyl)-N-pyridin-1-ium-2-yl-benzamide Openeye Name: N-benzyl-4-ethoxy-N-pyridin-1-ium-2-yl-benzamide CAS Name: 4-ethoxy-N-(phenylmethyl)-N-(2-pyridin-1-iumyl)benzamide IUPAC Name: N-benzyl-4-ethoxy-N-pyridin-1-ium-2-ylbenzamide Traditional Name: N-benzyl-4-ethoxy-N-pyridin-1-ium-2-yl-benzamide Formula: C21H21N2O2+ MolecularWeight: 333.40364

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)N(CC2=CC=CC=C2)C3=CC=CC=[NH+]3

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)N(CC2=CC=CC=C2)C3=CC=CC=[NH+]3

InChI

InChI=1S/C21H20N2O2/c1-2-25-19-13-11-18(12-14-19)21(24)23(20-10-6-7-15-22-20)16-17-8-4-3-5-9-17/h3-15H,2,16H2,1H3/p+1