5-ethanoyl-N-[(3S)-1-[(3-methoxyphenyl)methyl]piperidin-1-ium-3-yl]-2,4-dimethyl-1H-pyrrole-3-carboxamide

Systemtic Name: 5-ethanoyl-N-[(3S)-1-[(3-methoxyphenyl)methyl]piperidin-1-ium-3-yl]-2,4-dimethyl-1H-pyrrole-3-carboxamide Openeye Name: 5-acetyl-N-[(3S)-1-[(3-methoxyphenyl)methyl]piperidin-1-ium-3-yl]-2,4-dimethyl-1H-pyrrole-3-carboxamide CAS Name: 5-acetyl-N-[(3S)-1-[(3-methoxyphenyl)methyl]-3-piperidin-1-iumyl]-2,4-dimethyl-1H-pyrrole-3-carboxamide IUPAC Name: 5-acetyl-N-[(3S)-1-[(3-methoxyphenyl)methyl]piperidin-1-ium-3-yl]-2,4-dimethyl-1H-pyrrole-3-carboxamide Traditional Name: 5-acetyl-N-[(3S)-1-m-anisylpiperidin-1-ium-3-yl]-2,4-dimethyl-1H-pyrrole-3-carboxamide Formula: C22H30N3O3+ MolecularWeight: 384.4919

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)NC2CCC[NH+](C2)CC3=CC(=CC=C3)OC)C)C(=O)C

Isomeric SMILES

CC1=C(NC(=C1C(=O)N[C@H]2CCC[NH+](C2)CC3=CC(=CC=C3)OC)C)C(=O)C

InChI

InChI=1S/C22H29N3O3/c1-14-20(15(2)23-21(14)16(3)26)22(27)24-18-8-6-10-25(13-18)12-17-7-5-9-19(11-17)28-4/h5,7,9,11,18,23H,6,8,10,12-13H2,1-4H3,(H,24,27)/p+1/t18-/m0/s1