(4-tert-butylphenyl)-[4-(4-tert-butylphenyl)carbonyl-1,4-diazepan-1-yl]methanone

Systemtic Name: (4-tert-butylphenyl)-[4-(4-tert-butylphenyl)carbonyl-1,4-diazepan-1-yl]methanone Openeye Name: [4-(4-tert-butylbenzoyl)-1,4-diazepan-1-yl]-(4-tert-butylphenyl)methanone CAS Name: (4-tert-butylphenyl)-[4-[(4-tert-butylphenyl)-oxomethyl]-1,4-diazepan-1-yl]methanone IUPAC Name: [4-(4-tert-butylbenzoyl)-1,4-diazepan-1-yl]-(4-tert-butylphenyl)methanone Traditional Name: [4-(4-tert-butylbenzoyl)-1,4-diazepan-1-yl]-(4-tert-butylphenyl)methanone Formula: C27H36N2O2 MolecularWeight: 420.58694

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCCN(CC2)C(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCCN(CC2)C(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C27H36N2O2/c1-26(2,3)22-12-8-20(9-13-22)24(30)28-16-7-17-29(19-18-28)25(31)21-10-14-23(15-11-21)27(4,5)6/h8-15H,7,16-19H2,1-6H3