N-[2-[4-(4-methoxyphenyl)carbonylpiperidin-1-ium-1-yl]ethanoyl]-1-methyl-pyrrole-2-carboxamide

Systemtic Name: N-[2-[4-(4-methoxyphenyl)carbonylpiperidin-1-ium-1-yl]ethanoyl]-1-methyl-pyrrole-2-carboxamide Openeye Name: N-[2-[4-(4-methoxybenzoyl)piperidin-1-ium-1-yl]acetyl]-1-methyl-pyrrole-2-carboxamide CAS Name: N-[2-[4-[(4-methoxyphenyl)-oxomethyl]-1-piperidin-1-iumyl]-1-oxoethyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: N-[2-[4-(4-methoxybenzoyl)piperidin-1-ium-1-yl]acetyl]-1-methylpyrrole-2-carboxamide Traditional Name: 1-methyl-N-[2-(4-p-anisoylpiperidin-1-ium-1-yl)acetyl]pyrrole-2-carboxamide Formula: C21H26N3O4+ MolecularWeight: 384.44884

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(=O)NC(=O)C[NH+]2CCC(CC2)C(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CN1C=CC=C1C(=O)NC(=O)C[NH+]2CCC(CC2)C(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H25N3O4/c1-23-11-3-4-18(23)21(27)22-19(25)14-24-12-9-16(10-13-24)20(26)15-5-7-17(28-2)8-6-15/h3-8,11,16H,9-10,12-14H2,1-2H3,(H,22,25,27)/p+1