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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C)C)C(=O)NCC(C2=CC=CC=C2OC)[NH+]3CCCC3

Isomeric SMILES

CC1=C(NC(=C1C(=O)C)C)C(=O)NC[C@H](C2=CC=CC=C2OC)[NH+]3CCCC3

InChI

InChI=1S/C22H29N3O3/c1-14-20(16(3)26)15(2)24-21(14)22(27)23-13-18(25-11-7-8-12-25)17-9-5-6-10-19(17)28-4/h5-6,9-10,18,24H,7-8,11-13H2,1-4H3,(H,23,27)/p+1/t18-/m1/s1