methyl (Z)-2-[4,5-dimethyl-2-(2-phenylethynyl)cyclohexa-1,4-dien-1-yl]-3-methoxy-prop-2-enoate

Systemtic Name: methyl (Z)-2-[4,5-dimethyl-2-(2-phenylethynyl)cyclohexa-1,4-dien-1-yl]-3-methoxy-prop-2-enoate Openeye Name: methyl (Z)-2-[4,5-dimethyl-2-(2-phenylethynyl)cyclohexa-1,4-dien-1-yl]-3-methoxy-prop-2-enoate CAS Name: (Z)-2-[4,5-dimethyl-2-(2-phenylethynyl)-1-cyclohexa-1,4-dienyl]-3-methoxy-2-propenoic acid methyl ester IUPAC Name: methyl (Z)-2-[4,5-dimethyl-2-(2-phenylethynyl)cyclohexa-1,4-dien-1-yl]-3-methoxyprop-2-enoate Traditional Name: (Z)-2-[4,5-dimethyl-2-(2-phenylethynyl)cyclohexa-1,4-dien-1-yl]-3-methoxy-acrylic acid methyl ester Formula: C21H22O3 MolecularWeight: 322.39758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(=C(C1)C#CC2=CC=CC=C2)C(=COC)C(=O)OC)C

Isomeric SMILES

CC1=C(CC(=C(C1)C#CC2=CC=CC=C2)/C(=C/OC)/C(=O)OC)C

InChI

InChI=1S/C21H22O3/c1-15-12-18(11-10-17-8-6-5-7-9-17)19(13-16(15)2)20(14-23-3)21(22)24-4/h5-9,14H,12-13H2,1-4H3/b20-14-