N-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide

Systemtic Name: N-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide Openeye Name: N-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-5-isopropyl-3-methyl-isoxazole-4-carboxamide CAS Name: N-[(2R)-2-(2-chlorophenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-3-methyl-5-propan-2-yl-4-isoxazolecarboxamide IUPAC Name: N-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-ylethyl]-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide Traditional Name: N-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-5-isopropyl-3-methyl-isoxazole-4-carboxamide Formula: C20H27ClN3O2+ MolecularWeight: 376.90028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1C(=O)NCC(C2=CC=CC=C2Cl)[NH+]3CCCC3)C(C)C

Isomeric SMILES

CC1=NOC(=C1C(=O)NC[C@@H](C2=CC=CC=C2Cl)[NH+]3CCCC3)C(C)C

InChI

InChI=1S/C20H26ClN3O2/c1-13(2)19-18(14(3)23-26-19)20(25)22-12-17(24-10-6-7-11-24)15-8-4-5-9-16(15)21/h4-5,8-9,13,17H,6-7,10-12H2,1-3H3,(H,22,25)/p+1/t17-/m0/s1