4-(3-phenoxyphenyl)-1-[(2S)-2-pyrrolidin-1-ylcarbonylpyrrolidin-1-yl]butan-1-one

Systemtic Name: 4-(3-phenoxyphenyl)-1-[(2S)-2-pyrrolidin-1-ylcarbonylpyrrolidin-1-yl]butan-1-one Openeye Name: 4-(3-phenoxyphenyl)-1-[(2S)-2-(pyrrolidine-1-carbonyl)pyrrolidin-1-yl]butan-1-one CAS Name: 1-[(2S)-2-[oxo(1-pyrrolidinyl)methyl]-1-pyrrolidinyl]-4-(3-phenoxyphenyl)-1-butanone IUPAC Name: 4-(3-phenoxyphenyl)-1-[(2S)-2-(pyrrolidine-1-carbonyl)pyrrolidin-1-yl]butan-1-one Traditional Name: 4-(3-phenoxyphenyl)-1-[(2S)-2-(pyrrolidine-1-carbonyl)pyrrolidino]butan-1-one Formula: C25H30N2O3 MolecularWeight: 406.5173

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2CCCN2C(=O)CCCC3=CC(=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C(=O)[C@@H]2CCCN2C(=O)CCCC3=CC(=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C25H30N2O3/c28-24(27-18-8-14-23(27)25(29)26-16-4-5-17-26)15-7-10-20-9-6-13-22(19-20)30-21-11-2-1-3-12-21/h1-3,6,9,11-13,19,23H,4-5,7-8,10,14-18H2/t23-/m0/s1