methyl 3-methylidene-5-(phenylmethyl)-4,5-dihydro-1-benzoxepine-7-carboxylate

Systemtic Name: methyl 3-methylidene-5-(phenylmethyl)-4,5-dihydro-1-benzoxepine-7-carboxylate Openeye Name: methyl 5-benzyl-3-methylene-4,5-dihydro-1-benzoxepine-7-carboxylate CAS Name: 3-methylene-5-(phenylmethyl)-4,5-dihydro-1-benzoxepin-7-carboxylic acid methyl ester IUPAC Name: methyl 5-benzyl-3-methylidene-4,5-dihydro-1-benzoxepine-7-carboxylate Traditional Name: 5-benzyl-3-methylene-4,5-dihydro-1-benzoxepin-7-carboxylic acid methyl ester Formula: C20H20O3 MolecularWeight: 308.371

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)OCC(=C)CC2CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)OCC(=C)CC2CC3=CC=CC=C3

InChI

InChI=1S/C20H20O3/c1-14-10-17(11-15-6-4-3-5-7-15)18-12-16(20(21)22-2)8-9-19(18)23-13-14/h3-9,12,17H,1,10-11,13H2,2H3