3-[(4-tert-butylphenyl)amino]azepan-2-one

Systemtic Name: 3-[(4-tert-butylphenyl)amino]azepan-2-one Openeye Name: 3-(4-tert-butylanilino)azepan-2-one CAS Name: 3-(4-tert-butylanilino)-2-azepanone IUPAC Name: 3-(4-tert-butylanilino)azepan-2-one Traditional Name: 3-(4-tert-butylanilino)azepan-2-one Formula: C16H24N2O MolecularWeight: 260.37456

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC2CCCCNC2=O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC2CCCCNC2=O

InChI

InChI=1S/C16H24N2O/c1-16(2,3)12-7-9-13(10-8-12)18-14-6-4-5-11-17-15(14)19/h7-10,14,18H,4-6,11H2,1-3H3,(H,17,19)