(2S,3S)-6-[(1R)-1-cyclohexyl-5-phenyl-pent-2-ynyl]-3,4-dimethyl-2-phenyl-1,4-oxazepane-5,7-dione

Systemtic Name: (2S,3S)-6-[(1R)-1-cyclohexyl-5-phenyl-pent-2-ynyl]-3,4-dimethyl-2-phenyl-1,4-oxazepane-5,7-dione Openeye Name: (2S,3S)-6-[(1R)-1-cyclohexyl-5-phenyl-pent-2-ynyl]-3,4-dimethyl-2-phenyl-1,4-oxazepane-5,7-dione CAS Name: (2S,3S)-6-[(1R)-1-cyclohexyl-5-phenylpent-2-ynyl]-3,4-dimethyl-2-phenyl-1,4-oxazepane-5,7-dione IUPAC Name: (2S,3S)-6-[(1R)-1-cyclohexyl-5-phenylpent-2-ynyl]-3,4-dimethyl-2-phenyl-1,4-oxazepane-5,7-dione Traditional Name: (2S,3S)-6-[(1R)-1-cyclohexyl-5-phenyl-pent-2-ynyl]-3,4-dimethyl-2-phenyl-1,4-oxazepane-5,7-quinone Formula: C30H35NO3 MolecularWeight: 457.6038

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(OC(=O)C(C(=O)N1C)C(C#CCCC2=CC=CC=C2)C3CCCCC3)C4=CC=CC=C4

Isomeric SMILES

C[C@H]1[C@@H](OC(=O)C(C(=O)N1C)[C@H](C#CCCC2=CC=CC=C2)C3CCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C30H35NO3/c1-22-28(25-19-10-5-11-20-25)34-30(33)27(29(32)31(22)2)26(24-17-8-4-9-18-24)21-13-12-16-23-14-6-3-7-15-23/h3,5-7,10-11,14-15,19-20,22,24,26-28H,4,8-9,12,16-18H2,1-2H3/t22-,26+,27?,28+/m0/s1