(3R)-3-[4-[(3-methoxyphenyl)methyl]piperazin-4-ium-1-yl]carbonyl-1-phenyl-pyrrolidin-2-one

Systemtic Name: (3R)-3-[4-[(3-methoxyphenyl)methyl]piperazin-4-ium-1-yl]carbonyl-1-phenyl-pyrrolidin-2-one Openeye Name: (3R)-3-[4-[(3-methoxyphenyl)methyl]piperazin-4-ium-1-carbonyl]-1-phenyl-pyrrolidin-2-one CAS Name: (3R)-3-[[4-[(3-methoxyphenyl)methyl]-1-piperazin-4-iumyl]-oxomethyl]-1-phenyl-2-pyrrolidinone IUPAC Name: (3R)-3-[4-[(3-methoxyphenyl)methyl]piperazin-4-ium-1-carbonyl]-1-phenylpyrrolidin-2-one Traditional Name: (3R)-3-(4-m-anisylpiperazin-4-ium-1-carbonyl)-1-phenyl-2-pyrrolidone Formula: C23H28N3O3+ MolecularWeight: 394.48672

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C[NH+]2CCN(CC2)C(=O)C3CCN(C3=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)C[NH+]2CCN(CC2)C(=O)[C@H]3CCN(C3=O)C4=CC=CC=C4

InChI

InChI=1S/C23H27N3O3/c1-29-20-9-5-6-18(16-20)17-24-12-14-25(15-13-24)22(27)21-10-11-26(23(21)28)19-7-3-2-4-8-19/h2-9,16,21H,10-15,17H2,1H3/p+1/t21-/m1/s1