5-chloranyl-N-[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3,6-dimethyl-1-benzofuran-2-carboxamide

Systemtic Name: 5-chloranyl-N-[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3,6-dimethyl-1-benzofuran-2-carboxamide Openeye Name: 5-chloro-N-[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3,6-dimethyl-benzofuran-2-carboxamide CAS Name: 5-chloro-N-[(2S)-2-(4-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-3,6-dimethyl-2-benzofurancarboxamide IUPAC Name: 5-chloro-N-[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]-3,6-dimethyl-1-benzofuran-2-carboxamide Traditional Name: 5-chloro-N-[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3,6-dimethyl-coumarilamide Formula: C24H28ClN2O3+ MolecularWeight: 427.94372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C(OC2=C1)C(=O)NCC(C3=CC=C(C=C3)OC)[NH+]4CCCC4)C)Cl

Isomeric SMILES

CC1=C(C=C2C(=C(OC2=C1)C(=O)NC[C@H](C3=CC=C(C=C3)OC)[NH+]4CCCC4)C)Cl

InChI

InChI=1S/C24H27ClN2O3/c1-15-12-22-19(13-20(15)25)16(2)23(30-22)24(28)26-14-21(27-10-4-5-11-27)17-6-8-18(29-3)9-7-17/h6-9,12-13,21H,4-5,10-11,14H2,1-3H3,(H,26,28)/p+1/t21-/m1/s1