2-[1-[(E)-3-(4-chlorophenyl)prop-2-enoyl]pyrrolidin-1-ium-1-yl]-N-cyclohexyl-2-oxidanyl-ethanamide

Systemtic Name: 2-[1-[(E)-3-(4-chlorophenyl)prop-2-enoyl]pyrrolidin-1-ium-1-yl]-N-cyclohexyl-2-oxidanyl-ethanamide Openeye Name: 2-[1-[(E)-3-(4-chlorophenyl)prop-2-enoyl]pyrrolidin-1-ium-1-yl]-N-cyclohexyl-2-hydroxy-acetamide CAS Name: 2-[1-[(E)-3-(4-chlorophenyl)-1-oxoprop-2-enyl]-1-pyrrolidin-1-iumyl]-N-cyclohexyl-2-hydroxyacetamide IUPAC Name: 2-[1-[(E)-3-(4-chlorophenyl)prop-2-enoyl]pyrrolidin-1-ium-1-yl]-N-cyclohexyl-2-hydroxyacetamide Traditional Name: 2-[1-[(E)-3-(4-chlorophenyl)acryloyl]pyrrolidin-1-ium-1-yl]-N-cyclohexyl-2-hydroxy-acetamide Formula: C21H28ClN2O3+ MolecularWeight: 391.91162

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C([N+]2(CCCC2)C(=O)C=CC3=CC=C(C=C3)Cl)O

Isomeric SMILES

C1CCC(CC1)NC(=O)C([N+]2(CCCC2)C(=O)/C=C/C3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C21H27ClN2O3/c22-17-11-8-16(9-12-17)10-13-19(25)24(14-4-5-15-24)21(27)20(26)23-18-6-2-1-3-7-18/h8-13,18,21,27H,1-7,14-15H2/p+1/b13-10+