1-cyclohexyl-4-[(2S)-1-ethanoylpyrrolidin-2-yl]carbonyl-6-phenylmethoxy-1,4-diazepan-2-one

Systemtic Name: 1-cyclohexyl-4-[(2S)-1-ethanoylpyrrolidin-2-yl]carbonyl-6-phenylmethoxy-1,4-diazepan-2-one Openeye Name: 4-[(2S)-1-acetylpyrrolidine-2-carbonyl]-6-benzyloxy-1-cyclohexyl-1,4-diazepan-2-one CAS Name: 4-[[(2S)-1-acetyl-2-pyrrolidinyl]-oxomethyl]-1-cyclohexyl-6-phenylmethoxy-1,4-diazepan-2-one IUPAC Name: 4-[(2S)-1-acetylpyrrolidine-2-carbonyl]-1-cyclohexyl-6-phenylmethoxy-1,4-diazepan-2-one Traditional Name: 4-[(2S)-1-acetylprolyl]-6-benzoxy-1-cyclohexyl-1,4-diazepan-2-one Formula: C25H35N3O4 MolecularWeight: 441.5631

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCC1C(=O)N2CC(CN(C(=O)C2)C3CCCCC3)OCC4=CC=CC=C4

Isomeric SMILES

CC(=O)N1CCC[C@H]1C(=O)N2CC(CN(C(=O)C2)C3CCCCC3)OCC4=CC=CC=C4

InChI

InChI=1S/C25H35N3O4/c1-19(29)27-14-8-13-23(27)25(31)26-15-22(32-18-20-9-4-2-5-10-20)16-28(24(30)17-26)21-11-6-3-7-12-21/h2,4-5,9-10,21-23H,3,6-8,11-18H2,1H3/t22?,23-/m0/s1