1-[(2S)-2-[4-[(2-methoxy-5-propan-2-yl-phenyl)methyl]piperazin-1-yl]carbonylpyrrolidin-1-yl]-2-phenyl-ethanone

Systemtic Name: 1-[(2S)-2-[4-[(2-methoxy-5-propan-2-yl-phenyl)methyl]piperazin-1-yl]carbonylpyrrolidin-1-yl]-2-phenyl-ethanone Openeye Name: 1-[(2S)-2-[4-[(5-isopropyl-2-methoxy-phenyl)methyl]piperazine-1-carbonyl]pyrrolidin-1-yl]-2-phenyl-ethanone CAS Name: 1-[(2S)-2-[[4-[(2-methoxy-5-propan-2-ylphenyl)methyl]-1-piperazinyl]-oxomethyl]-1-pyrrolidinyl]-2-phenylethanone IUPAC Name: 1-[(2S)-2-[4-[(2-methoxy-5-propan-2-ylphenyl)methyl]piperazine-1-carbonyl]pyrrolidin-1-yl]-2-phenylethanone Traditional Name: 1-[(2S)-2-[4-(5-isopropyl-2-methoxy-benzyl)piperazine-1-carbonyl]pyrrolidino]-2-phenyl-ethanone Formula: C28H37N3O3 MolecularWeight: 463.61168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C=C1)OC)CN2CCN(CC2)C(=O)C3CCCN3C(=O)CC4=CC=CC=C4

Isomeric SMILES

CC(C)C1=CC(=C(C=C1)OC)CN2CCN(CC2)C(=O)[C@@H]3CCCN3C(=O)CC4=CC=CC=C4

InChI

InChI=1S/C28H37N3O3/c1-21(2)23-11-12-26(34-3)24(19-23)20-29-14-16-30(17-15-29)28(33)25-10-7-13-31(25)27(32)18-22-8-5-4-6-9-22/h4-6,8-9,11-12,19,21,25H,7,10,13-18,20H2,1-3H3/t25-/m0/s1