1-[3-(4-tert-butylphenyl)-2-methyl-propyl]-3,5,5-trimethyl-azepane

Systemtic Name: 1-[3-(4-tert-butylphenyl)-2-methyl-propyl]-3,5,5-trimethyl-azepane Openeye Name: 1-[3-(4-tert-butylphenyl)-2-methyl-propyl]-3,5,5-trimethyl-azepane CAS Name: 1-[3-(4-tert-butylphenyl)-2-methylpropyl]-3,5,5-trimethylazepane IUPAC Name: 1-[3-(4-tert-butylphenyl)-2-methylpropyl]-3,5,5-trimethylazepane Traditional Name: 1-[3-(4-tert-butylphenyl)-2-methyl-propyl]-3,5,5-trimethyl-azepane Formula: C23H39N MolecularWeight: 329.56246

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CCN(C1)CC(C)CC2=CC=C(C=C2)C(C)(C)C)(C)C

Isomeric SMILES

CC1CC(CCN(C1)CC(C)CC2=CC=C(C=C2)C(C)(C)C)(C)C

InChI

InChI=1S/C23H39N/c1-18(14-20-8-10-21(11-9-20)22(3,4)5)16-24-13-12-23(6,7)15-19(2)17-24/h8-11,18-19H,12-17H2,1-7H3