2-[[(2S)-butan-2-yl]iminomethyl]-5-phenyl-cyclohexane-1,3-dione

Systemtic Name: 2-[[(2S)-butan-2-yl]iminomethyl]-5-phenyl-cyclohexane-1,3-dione Openeye Name: 2-[[(1S)-1-methylpropyl]iminomethyl]-5-phenyl-cyclohexane-1,3-dione CAS Name: 2-[[(2S)-butan-2-yl]iminomethyl]-5-phenylcyclohexane-1,3-dione IUPAC Name: 2-[[(2S)-butan-2-yl]iminomethyl]-5-phenylcyclohexane-1,3-dione Traditional Name: 2-[[(1S)-1-methylpropyl]iminomethyl]-5-phenyl-cyclohexane-1,3-quinone Formula: C17H21NO2 MolecularWeight: 271.35414

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N=CC1C(=O)CC(CC1=O)C2=CC=CC=C2

Isomeric SMILES

CC[C@H](C)N=CC1C(=O)CC(CC1=O)C2=CC=CC=C2

InChI

InChI=1S/C17H21NO2/c1-3-12(2)18-11-15-16(19)9-14(10-17(15)20)13-7-5-4-6-8-13/h4-8,11-12,14-15H,3,9-10H2,1-2H3/t12-,14?,15?/m0/s1