6-methoxy-3-methyl-8-phenethyl-2,5-dihydro-1-benzoxepine-7-carbaldehyde

Systemtic Name: 6-methoxy-3-methyl-8-phenethyl-2,5-dihydro-1-benzoxepine-7-carbaldehyde Openeye Name: 6-methoxy-3-methyl-8-phenethyl-2,5-dihydro-1-benzoxepine-7-carbaldehyde CAS Name: 6-methoxy-3-methyl-8-phenethyl-2,5-dihydro-1-benzoxepin-7-carboxaldehyde IUPAC Name: 6-methoxy-3-methyl-8-phenethyl-2,5-dihydro-1-benzoxepine-7-carbaldehyde Traditional Name: 6-methoxy-3-methyl-8-phenethyl-2,5-dihydro-1-benzoxepin-7-carbaldehyde Formula: C21H22O3 MolecularWeight: 322.39758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC2=C(C=C(C(=C2OC)C=O)CCC3=CC=CC=C3)OC1

Isomeric SMILES

CC1=CCC2=C(C=C(C(=C2OC)C=O)CCC3=CC=CC=C3)OC1

InChI

InChI=1S/C21H22O3/c1-15-8-11-18-20(24-14-15)12-17(19(13-22)21(18)23-2)10-9-16-6-4-3-5-7-16/h3-8,12-13H,9-11,14H2,1-2H3