3-tert-butyl-N-[(1-propylpyridin-1-ium-2-yl)methyl]-4-tetradecoxy-benzamide

Systemtic Name: 3-tert-butyl-N-[(1-propylpyridin-1-ium-2-yl)methyl]-4-tetradecoxy-benzamide Openeye Name: 3-tert-butyl-N-[(1-propylpyridin-1-ium-2-yl)methyl]-4-tetradecoxy-benzamide CAS Name: 3-tert-butyl-N-[(1-propyl-2-pyridin-1-iumyl)methyl]-4-tetradecoxybenzamide IUPAC Name: 3-tert-butyl-N-[(1-propylpyridin-1-ium-2-yl)methyl]-4-tetradecoxybenzamide Traditional Name: 3-tert-butyl-4-myristyloxy-N-[(1-propylpyridin-1-ium-2-yl)methyl]benzamide Formula: C34H55N2O2+ MolecularWeight: 523.8127

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)C(=O)NCC2=CC=CC=[N+]2CCC)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)C(=O)NCC2=CC=CC=[N+]2CCC)C(C)(C)C

InChI

InChI=1S/C34H54N2O2/c1-6-8-9-10-11-12-13-14-15-16-17-20-26-38-32-23-22-29(27-31(32)34(3,4)5)33(37)35-28-30-21-18-19-25-36(30)24-7-2/h18-19,21-23,25,27H,6-17,20,24,26,28H2,1-5H3/p+1