methyl 11-(dimethylaminomethyl)-11-oxidanyl-6H-benzo[c][1]benzoxepine-8-carboxylate

Systemtic Name: methyl 11-(dimethylaminomethyl)-11-oxidanyl-6H-benzo[c][1]benzoxepine-8-carboxylate Openeye Name: methyl 11-(dimethylaminomethyl)-11-hydroxy-6H-benzo[c][1]benzoxepine-8-carboxylate CAS Name: 11-(dimethylaminomethyl)-11-hydroxy-6H-benzo[c][1]benzoxepin-8-carboxylic acid methyl ester IUPAC Name: methyl 11-(dimethylaminomethyl)-11-hydroxy-6H-benzo[c][1]benzoxepine-8-carboxylate Traditional Name: 11-(dimethylaminomethyl)-11-hydroxy-6H-benzo[c][1]benzoxepin-8-carboxylic acid methyl ester Formula: C19H21NO4 MolecularWeight: 327.37434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1(C2=C(COC3=CC=CC=C31)C=C(C=C2)C(=O)OC)O

Isomeric SMILES

CN(C)CC1(C2=C(COC3=CC=CC=C31)C=C(C=C2)C(=O)OC)O

InChI

InChI=1S/C19H21NO4/c1-20(2)12-19(22)15-9-8-13(18(21)23-3)10-14(15)11-24-17-7-5-4-6-16(17)19/h4-10,22H,11-12H2,1-3H3