4-[(2-ethanoylphenyl)methylamino]-2,6,6-trimethyl-5-oxidanyl-cyclohept-2-en-1-one

Systemtic Name: 4-[(2-ethanoylphenyl)methylamino]-2,6,6-trimethyl-5-oxidanyl-cyclohept-2-en-1-one Openeye Name: 4-[(2-acetylphenyl)methylamino]-5-hydroxy-2,6,6-trimethyl-cyclohept-2-en-1-one CAS Name: 4-[(2-acetylphenyl)methylamino]-5-hydroxy-2,6,6-trimethyl-1-cyclohept-2-enone IUPAC Name: 4-[(2-acetylphenyl)methylamino]-5-hydroxy-2,6,6-trimethylcyclohept-2-en-1-one Traditional Name: 4-[(2-acetylbenzyl)amino]-5-hydroxy-2,6,6-trimethyl-cyclohept-2-en-1-one Formula: C19H25NO3 MolecularWeight: 315.4067

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(C(C(CC1=O)(C)C)O)NCC2=CC=CC=C2C(=O)C

Isomeric SMILES

CC1=CC(C(C(CC1=O)(C)C)O)NCC2=CC=CC=C2C(=O)C

InChI

InChI=1S/C19H25NO3/c1-12-9-16(18(23)19(3,4)10-17(12)22)20-11-14-7-5-6-8-15(14)13(2)21/h5-9,16,18,20,23H,10-11H2,1-4H3