3-[[2-azanyl-4-(4-methylphenoxy)phenyl]amino]-5,5-dimethyl-cyclohex-2-en-1-one

Systemtic Name: 3-[[2-azanyl-4-(4-methylphenoxy)phenyl]amino]-5,5-dimethyl-cyclohex-2-en-1-one Openeye Name: 3-[2-amino-4-(4-methylphenoxy)anilino]-5,5-dimethyl-cyclohex-2-en-1-one CAS Name: 3-[2-amino-4-(4-methylphenoxy)anilino]-5,5-dimethyl-1-cyclohex-2-enone IUPAC Name: 3-[2-amino-4-(4-methylphenoxy)anilino]-5,5-dimethylcyclohex-2-en-1-one Traditional Name: 3-[2-amino-4-(4-methylphenoxy)anilino]-5,5-dimethyl-cyclohex-2-en-1-one Formula: C21H24N2O2 MolecularWeight: 336.42746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=CC(=C(C=C2)NC3=CC(=O)CC(C3)(C)C)N

Isomeric SMILES

CC1=CC=C(C=C1)OC2=CC(=C(C=C2)NC3=CC(=O)CC(C3)(C)C)N

InChI

InChI=1S/C21H24N2O2/c1-14-4-6-17(7-5-14)25-18-8-9-20(19(22)11-18)23-15-10-16(24)13-21(2,3)12-15/h4-11,23H,12-13,22H2,1-3H3