(2R)-2-[4-(2-chlorophenyl)carbonylpiperazin-1-ium-1-yl]-N-cyclopentyl-propanamide

Systemtic Name: (2R)-2-[4-(2-chlorophenyl)carbonylpiperazin-1-ium-1-yl]-N-cyclopentyl-propanamide Openeye Name: (2R)-2-[4-(2-chlorobenzoyl)piperazin-1-ium-1-yl]-N-cyclopentyl-propanamide CAS Name: (2R)-2-[4-[(2-chlorophenyl)-oxomethyl]-1-piperazin-1-iumyl]-N-cyclopentylpropanamide IUPAC Name: (2R)-2-[4-(2-chlorobenzoyl)piperazin-1-ium-1-yl]-N-cyclopentylpropanamide Traditional Name: (2R)-2-[4-(2-chlorobenzoyl)piperazin-1-ium-1-yl]-N-cyclopentyl-propionamide Formula: C19H27ClN3O2+ MolecularWeight: 364.88958

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCC1)[NH+]2CCN(CC2)C(=O)C3=CC=CC=C3Cl

Isomeric SMILES

C[C@H](C(=O)NC1CCCC1)[NH+]2CCN(CC2)C(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C19H26ClN3O2/c1-14(18(24)21-15-6-2-3-7-15)22-10-12-23(13-11-22)19(25)16-8-4-5-9-17(16)20/h4-5,8-9,14-15H,2-3,6-7,10-13H2,1H3,(H,21,24)/p+1/t14-/m1/s1