2,2,5,7-tetramethyl-4-[[4-(phenylmethyl)-1,4-diazepan-1-yl]carbonyl]-3H-inden-1-one

Systemtic Name: 2,2,5,7-tetramethyl-4-[[4-(phenylmethyl)-1,4-diazepan-1-yl]carbonyl]-3H-inden-1-one Openeye Name: 4-(4-benzyl-1,4-diazepane-1-carbonyl)-2,2,5,7-tetramethyl-indan-1-one CAS Name: 2,2,5,7-tetramethyl-4-[oxo-[4-(phenylmethyl)-1,4-diazepan-1-yl]methyl]-3H-inden-1-one IUPAC Name: 4-(4-benzyl-1,4-diazepane-1-carbonyl)-2,2,5,7-tetramethyl-3H-inden-1-one Traditional Name: 4-(4-benzyl-1,4-diazepane-1-carbonyl)-2,2,5,7-tetramethyl-indan-1-one Formula: C26H32N2O2 MolecularWeight: 404.54448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C2=C1C(=O)C(C2)(C)C)C(=O)N3CCCN(CC3)CC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C2=C1C(=O)C(C2)(C)C)C(=O)N3CCCN(CC3)CC4=CC=CC=C4)C

InChI

InChI=1S/C26H32N2O2/c1-18-15-19(2)23(21-16-26(3,4)24(29)22(18)21)25(30)28-12-8-11-27(13-14-28)17-20-9-6-5-7-10-20/h5-7,9-10,15H,8,11-14,16-17H2,1-4H3