5,5-dimethyl-2-[(E)-3-[(2-methylphenyl)amino]prop-2-enoyl]cyclohexane-1,3-dione

Systemtic Name: 5,5-dimethyl-2-[(E)-3-[(2-methylphenyl)amino]prop-2-enoyl]cyclohexane-1,3-dione Openeye Name: 5,5-dimethyl-2-[(E)-3-(2-methylanilino)prop-2-enoyl]cyclohexane-1,3-dione CAS Name: 5,5-dimethyl-2-[(E)-3-(2-methylanilino)-1-oxoprop-2-enyl]cyclohexane-1,3-dione IUPAC Name: 5,5-dimethyl-2-[(E)-3-(2-methylanilino)prop-2-enoyl]cyclohexane-1,3-dione Traditional Name: 5,5-dimethyl-2-[(E)-3-(o-toluidino)acryloyl]cyclohexane-1,3-quinone Formula: C18H21NO3 MolecularWeight: 299.36424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC=CC(=O)C2C(=O)CC(CC2=O)(C)C

Isomeric SMILES

CC1=CC=CC=C1N/C=C/C(=O)C2C(=O)CC(CC2=O)(C)C

InChI

InChI=1S/C18H21NO3/c1-12-6-4-5-7-13(12)19-9-8-14(20)17-15(21)10-18(2,3)11-16(17)22/h4-9,17,19H,10-11H2,1-3H3/b9-8+