1-[(2R,5S)-5-bromanyl-4-tert-butyl-7-[(4-tert-butyl-7-methoxy-2H-azepin-2-yl)oxy]-5,6-dihydro-2H-azepin-2-yl]pyrrolidine-2,5-dione

Systemtic Name: 1-[(2R,5S)-5-bromanyl-4-tert-butyl-7-[(4-tert-butyl-7-methoxy-2H-azepin-2-yl)oxy]-5,6-dihydro-2H-azepin-2-yl]pyrrolidine-2,5-dione Openeye Name: 1-[(2R,5S)-5-bromo-4-tert-butyl-7-[(4-tert-butyl-7-methoxy-2H-azepin-2-yl)oxy]-5,6-dihydro-2H-azepin-2-yl]pyrrolidine-2,5-dione CAS Name: 1-[(2R,5S)-5-bromo-4-tert-butyl-7-[(4-tert-butyl-7-methoxy-2H-azepin-2-yl)oxy]-5,6-dihydro-2H-azepin-2-yl]pyrrolidine-2,5-dione IUPAC Name: 1-[(2R,5S)-5-bromo-4-tert-butyl-7-[(4-tert-butyl-7-methoxy-2H-azepin-2-yl)oxy]-5,6-dihydro-2H-azepin-2-yl]pyrrolidine-2,5-dione Traditional Name: 1-[(2R,5S)-5-bromo-4-tert-butyl-7-[(4-tert-butyl-7-methoxy-2H-azepin-2-yl)oxy]-5,6-dihydro-2H-azepin-2-yl]pyrrolidine-2,5-quinone Formula: C25H34BrN3O4 MolecularWeight: 520.45916

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(N=C(C=C1)OC)OC2=NC(C=C(C(C2)Br)C(C)(C)C)N3C(=O)CCC3=O

Isomeric SMILES

CC(C)(C)C1=CC(N=C(C=C1)OC)OC2=N[C@@H](C=C([C@H](C2)Br)C(C)(C)C)N3C(=O)CCC3=O

InChI

InChI=1S/C25H34BrN3O4/c1-24(2,3)15-8-9-19(32-7)28-20(12-15)33-21-14-17(26)16(25(4,5)6)13-18(27-21)29-22(30)10-11-23(29)31/h8-9,12-13,17-18,20H,10-11,14H2,1-7H3/t17-,18+,20?/m0/s1