methyl 4-methanidyl-2,2-dimethyl-4-phenyl-hexanoate

Systemtic Name: methyl 4-methanidyl-2,2-dimethyl-4-phenyl-hexanoate Openeye Name: methyl 4-methanidyl-2,2-dimethyl-4-phenyl-hexanoate CAS Name: 4-methanidyl-2,2-dimethyl-4-phenylhexanoic acid methyl ester IUPAC Name: methyl 4-methanidyl-2,2-dimethyl-4-phenylhexanoate Traditional Name: 4-methanidyl-2,2-dimethyl-4-phenyl-hexanoic acid methyl ester Formula: C16H23O2- MolecularWeight: 247.35262

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Descriptors Computed from Structure

Canonical SMILES:

CCC([CH2-])(CC(C)(C)C(=O)OC)C1=CC=CC=C1

Isomeric SMILES

CCC([CH2-])(CC(C)(C)C(=O)OC)C1=CC=CC=C1

InChI

InChI=1S/C16H23O2/c1-6-16(4,13-10-8-7-9-11-13)12-15(2,3)14(17)18-5/h7-11H,4,6,12H2,1-3,5H3/q-1