ethyl 4-[(E)-2-(7,7-dimethyl-5,6,8,9-tetrahydrobenzo[7]annulen-3-yl)prop-1-enyl]benzoate

Systemtic Name: ethyl 4-[(E)-2-(7,7-dimethyl-5,6,8,9-tetrahydrobenzo[7]annulen-3-yl)prop-1-enyl]benzoate Openeye Name: ethyl 4-[(E)-2-(7,7-dimethyl-5,6,8,9-tetrahydrobenzo[7]annulen-3-yl)prop-1-enyl]benzoate CAS Name: 4-[(E)-2-(7,7-dimethyl-5,6,8,9-tetrahydrobenzo[7]annulen-3-yl)prop-1-enyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(E)-2-(7,7-dimethyl-5,6,8,9-tetrahydrobenzo[7]annulen-3-yl)prop-1-enyl]benzoate Traditional Name: 4-[(E)-2-(7,7-dimethyl-5,6,8,9-tetrahydrobenzocyclohepten-3-yl)prop-1-enyl]benzoic acid ethyl ester Formula: C25H30O2 MolecularWeight: 362.5045

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C=C(C)C2=CC3=C(CCC(CC3)(C)C)C=C2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)/C=C(\C)/C2=CC3=C(CCC(CC3)(C)C)C=C2

InChI

InChI=1S/C25H30O2/c1-5-27-24(26)21-8-6-19(7-9-21)16-18(2)22-11-10-20-12-14-25(3,4)15-13-23(20)17-22/h6-11,16-17H,5,12-15H2,1-4H3/b18-16+