3-chloranyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]-N-(phenylcarbonyl)-4-tetradecoxy-benzamide

Systemtic Name: 3-chloranyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]-N-(phenylcarbonyl)-4-tetradecoxy-benzamide Openeye Name: N-benzoyl-3-chloro-N-[(1-ethylpyridin-1-ium-2-yl)methyl]-4-tetradecoxy-benzamide CAS Name: N-benzoyl-3-chloro-N-[(1-ethyl-2-pyridin-1-iumyl)methyl]-4-tetradecoxybenzamide IUPAC Name: N-benzoyl-3-chloro-N-[(1-ethylpyridin-1-ium-2-yl)methyl]-4-tetradecoxybenzamide Traditional Name: N-benzoyl-3-chloro-N-[(1-ethylpyridin-1-ium-2-yl)methyl]-4-myristyloxy-benzamide Formula: C36H48ClN2O3+ MolecularWeight: 592.23092

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)C(=O)N(CC2=CC=CC=[N+]2CC)C(=O)C3=CC=CC=C3)Cl

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)C(=O)N(CC2=CC=CC=[N+]2CC)C(=O)C3=CC=CC=C3)Cl

InChI

InChI=1S/C36H48ClN2O3/c1-3-5-6-7-8-9-10-11-12-13-14-20-27-42-34-25-24-31(28-33(34)37)36(41)39(35(40)30-21-16-15-17-22-30)29-32-23-18-19-26-38(32)4-2/h15-19,21-26,28H,3-14,20,27,29H2,1-2H3/q+1