N-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-methoxy-4-methyl-benzamide

Systemtic Name: N-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-methoxy-4-methyl-benzamide Openeye Name: N-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-methoxy-4-methyl-benzamide CAS Name: N-[(2R)-2-(2-chlorophenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-3-methoxy-4-methylbenzamide IUPAC Name: N-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-ylethyl]-3-methoxy-4-methylbenzamide Traditional Name: N-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-methoxy-4-methyl-benzamide Formula: C21H26ClN2O2+ MolecularWeight: 373.89634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC(C2=CC=CC=C2Cl)[NH+]3CCCC3)OC

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC[C@@H](C2=CC=CC=C2Cl)[NH+]3CCCC3)OC

InChI

InChI=1S/C21H25ClN2O2/c1-15-9-10-16(13-20(15)26-2)21(25)23-14-19(24-11-5-6-12-24)17-7-3-4-8-18(17)22/h3-4,7-10,13,19H,5-6,11-12,14H2,1-2H3,(H,23,25)/p+1/t19-/m0/s1