N-[3,3-dimethyl-5-(3-methylbutyl)-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl]-1-(4-methylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: N-[3,3-dimethyl-5-(3-methylbutyl)-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl]-1-(4-methylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-(5-isopentyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)-5-oxo-1-(p-tolyl)pyrrolidine-3-carboxamide CAS Name: N-[3,3-dimethyl-5-(3-methylbutyl)-4-oxo-2H-1,5-benzoxazepin-8-yl]-1-(4-methylphenyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-[3,3-dimethyl-5-(3-methylbutyl)-4-oxo-2H-1,5-benzoxazepin-8-yl]-1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: N-(5-isoamyl-4-keto-3,3-dimethyl-2H-1,5-benzoxazepin-8-yl)-5-keto-1-(p-tolyl)pyrrolidine-3-carboxamide Formula: C28H35N3O4 MolecularWeight: 477.5952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NC3=CC4=C(C=C3)N(C(=O)C(CO4)(C)C)CCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NC3=CC4=C(C=C3)N(C(=O)C(CO4)(C)C)CCC(C)C

InChI

InChI=1S/C28H35N3O4/c1-18(2)12-13-30-23-11-8-21(15-24(23)35-17-28(4,5)27(30)34)29-26(33)20-14-25(32)31(16-20)22-9-6-19(3)7-10-22/h6-11,15,18,20H,12-14,16-17H2,1-5H3,(H,29,33)