(4S)-1-(3-chloranyl-4-methyl-phenyl)-4-(4-ethylpiperazin-4-ium-1-yl)carbonyl-pyrrolidin-2-one

Systemtic Name: (4S)-1-(3-chloranyl-4-methyl-phenyl)-4-(4-ethylpiperazin-4-ium-1-yl)carbonyl-pyrrolidin-2-one Openeye Name: (4S)-1-(3-chloro-4-methyl-phenyl)-4-(4-ethylpiperazin-4-ium-1-carbonyl)pyrrolidin-2-one CAS Name: (4S)-1-(3-chloro-4-methylphenyl)-4-[(4-ethyl-1-piperazin-4-iumyl)-oxomethyl]-2-pyrrolidinone IUPAC Name: (4S)-1-(3-chloro-4-methylphenyl)-4-(4-ethylpiperazin-4-ium-1-carbonyl)pyrrolidin-2-one Traditional Name: (4S)-1-(3-chloro-4-methyl-phenyl)-4-(4-ethylpiperazin-4-ium-1-carbonyl)-2-pyrrolidone Formula: C18H25ClN3O2+ MolecularWeight: 350.863

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2CC(=O)N(C2)C3=CC(=C(C=C3)C)Cl

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)[C@H]2CC(=O)N(C2)C3=CC(=C(C=C3)C)Cl

InChI

InChI=1S/C18H24ClN3O2/c1-3-20-6-8-21(9-7-20)18(24)14-10-17(23)22(12-14)15-5-4-13(2)16(19)11-15/h4-5,11,14H,3,6-10,12H2,1-2H3/p+1/t14-/m0/s1