1-[(2S,4S)-4-(4-chloranylphenoxy)-2-pyrrolidin-1-ylcarbonyl-pyrrolidin-1-yl]-4-phenyl-butan-1-one

Systemtic Name: 1-[(2S,4S)-4-(4-chloranylphenoxy)-2-pyrrolidin-1-ylcarbonyl-pyrrolidin-1-yl]-4-phenyl-butan-1-one Openeye Name: 1-[(2S,4S)-4-(4-chlorophenoxy)-2-(pyrrolidine-1-carbonyl)pyrrolidin-1-yl]-4-phenyl-butan-1-one CAS Name: 1-[(2S,4S)-4-(4-chlorophenoxy)-2-[oxo(1-pyrrolidinyl)methyl]-1-pyrrolidinyl]-4-phenyl-1-butanone IUPAC Name: 1-[(2S,4S)-4-(4-chlorophenoxy)-2-(pyrrolidine-1-carbonyl)pyrrolidin-1-yl]-4-phenylbutan-1-one Traditional Name: 1-[(2S,4S)-4-(4-chlorophenoxy)-2-(pyrrolidine-1-carbonyl)pyrrolidino]-4-phenyl-butan-1-one Formula: C25H29ClN2O3 MolecularWeight: 440.96236

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2CC(CN2C(=O)CCCC3=CC=CC=C3)OC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCN(C1)C(=O)[C@@H]2C[C@@H](CN2C(=O)CCCC3=CC=CC=C3)OC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H29ClN2O3/c26-20-11-13-21(14-12-20)31-22-17-23(25(30)27-15-4-5-16-27)28(18-22)24(29)10-6-9-19-7-2-1-3-8-19/h1-3,7-8,11-14,22-23H,4-6,9-10,15-18H2/t22-,23-/m0/s1