1-cyclohexyl-4-[(3S,4S)-1-(4-methoxyphenyl)carbonyl-4-oxidanyl-pyrrolidin-3-yl]piperazin-2-one

Systemtic Name: 1-cyclohexyl-4-[(3S,4S)-1-(4-methoxyphenyl)carbonyl-4-oxidanyl-pyrrolidin-3-yl]piperazin-2-one Openeye Name: 1-cyclohexyl-4-[(3S,4S)-4-hydroxy-1-(4-methoxybenzoyl)pyrrolidin-3-yl]piperazin-2-one CAS Name: 1-cyclohexyl-4-[(3S,4S)-4-hydroxy-1-[(4-methoxyphenyl)-oxomethyl]-3-pyrrolidinyl]-2-piperazinone IUPAC Name: 1-cyclohexyl-4-[(3S,4S)-4-hydroxy-1-(4-methoxybenzoyl)pyrrolidin-3-yl]piperazin-2-one Traditional Name: 1-cyclohexyl-4-[(3S,4S)-4-hydroxy-1-p-anisoyl-pyrrolidin-3-yl]piperazin-2-one Formula: C22H31N3O4 MolecularWeight: 401.49924

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N2CC(C(C2)O)N3CCN(C(=O)C3)C4CCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N2C[C@@H]([C@H](C2)O)N3CCN(C(=O)C3)C4CCCCC4

InChI

InChI=1S/C22H31N3O4/c1-29-18-9-7-16(8-10-18)22(28)24-13-19(20(26)14-24)23-11-12-25(21(27)15-23)17-5-3-2-4-6-17/h7-10,17,19-20,26H,2-6,11-15H2,1H3/t19-,20-/m0/s1