4,4-dimethyl-2-[(5S,6S)-6-phenyl-5-prop-2-ynyl-cyclohexa-1,3-dien-1-yl]-5H-1,3-oxazole

Systemtic Name: 4,4-dimethyl-2-[(5S,6S)-6-phenyl-5-prop-2-ynyl-cyclohexa-1,3-dien-1-yl]-5H-1,3-oxazole Openeye Name: 4,4-dimethyl-2-[(5S,6S)-6-phenyl-5-prop-2-ynyl-cyclohexa-1,3-dien-1-yl]-5H-oxazole CAS Name: 4,4-dimethyl-2-[(5S,6S)-6-phenyl-5-prop-2-ynyl-1-cyclohexa-1,3-dienyl]-5H-oxazole IUPAC Name: 4,4-dimethyl-2-[(5S,6S)-6-phenyl-5-prop-2-ynylcyclohexa-1,3-dien-1-yl]-5H-1,3-oxazole Traditional Name: 4,4-dimethyl-2-[(5S,6S)-6-phenyl-5-propargyl-cyclohexa-1,3-dien-1-yl]-2-oxazoline Formula: C20H21NO MolecularWeight: 291.38684

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(=N1)C2=CC=CC(C2C3=CC=CC=C3)CC#C)C

Isomeric SMILES

CC1(COC(=N1)C2=CC=C[C@@H]([C@H]2C3=CC=CC=C3)CC#C)C

InChI

InChI=1S/C20H21NO/c1-4-9-15-12-8-13-17(19-21-20(2,3)14-22-19)18(15)16-10-6-5-7-11-16/h1,5-8,10-13,15,18H,9,14H2,2-3H3/t15-,18-/m0/s1