4-[4-[1-(4-tert-butylphenyl)propan-2-yl-propyl-amino]butyl]-1,4-diazepan-5-one

Systemtic Name: 4-[4-[1-(4-tert-butylphenyl)propan-2-yl-propyl-amino]butyl]-1,4-diazepan-5-one Openeye Name: 4-[4-[[2-(4-tert-butylphenyl)-1-methyl-ethyl]-propyl-amino]butyl]-1,4-diazepan-5-one CAS Name: 4-[4-[1-(4-tert-butylphenyl)propan-2-yl-propylamino]butyl]-1,4-diazepan-5-one IUPAC Name: 4-[4-[1-(4-tert-butylphenyl)propan-2-yl-propylamino]butyl]-1,4-diazepan-5-one Traditional Name: 4-[4-[[2-(4-tert-butylphenyl)-1-methyl-ethyl]-propyl-amino]butyl]-1,4-diazepan-5-one Formula: C25H43N3O MolecularWeight: 401.62842

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCCCN1CCNCCC1=O)C(C)CC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CCCN(CCCCN1CCNCCC1=O)C(C)CC2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C25H43N3O/c1-6-16-27(17-7-8-18-28-19-15-26-14-13-24(28)29)21(2)20-22-9-11-23(12-10-22)25(3,4)5/h9-12,21,26H,6-8,13-20H2,1-5H3