(4S)-1-[(2-chlorophenyl)methyl]-4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)carbonyl-pyrrolidin-2-one

Systemtic Name: (4S)-1-[(2-chlorophenyl)methyl]-4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)carbonyl-pyrrolidin-2-one Openeye Name: (4S)-1-[(2-chlorophenyl)methyl]-4-(4-pyridin-1-ium-2-ylpiperazine-1-carbonyl)pyrrolidin-2-one CAS Name: (4S)-1-[(2-chlorophenyl)methyl]-4-[oxo-[4-(2-pyridin-1-iumyl)-1-piperazinyl]methyl]-2-pyrrolidinone IUPAC Name: (4S)-1-[(2-chlorophenyl)methyl]-4-(4-pyridin-1-ium-2-ylpiperazine-1-carbonyl)pyrrolidin-2-one Traditional Name: (4S)-1-(2-chlorobenzyl)-4-(4-pyridin-1-ium-2-ylpiperazine-1-carbonyl)-2-pyrrolidone Formula: C21H24ClN4O2+ MolecularWeight: 399.89386

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)C3CC(=O)N(C3)CC4=CC=CC=C4Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)[C@H]3CC(=O)N(C3)CC4=CC=CC=C4Cl

InChI

InChI=1S/C21H23ClN4O2/c22-18-6-2-1-5-16(18)14-26-15-17(13-20(26)27)21(28)25-11-9-24(10-12-25)19-7-3-4-8-23-19/h1-8,17H,9-15H2/p+1/t17-/m0/s1