methyl (11E)-11-[3-(diethylamino)propylidene]-6H-benzo[c][1]benzoxepine-2-carboxylate

Systemtic Name: methyl (11E)-11-[3-(diethylamino)propylidene]-6H-benzo[c][1]benzoxepine-2-carboxylate Openeye Name: methyl (11E)-11-[3-(diethylamino)propylidene]-6H-benzo[c][1]benzoxepine-2-carboxylate CAS Name: (11E)-11-[3-(diethylamino)propylidene]-6H-benzo[c][1]benzoxepin-2-carboxylic acid methyl ester IUPAC Name: methyl (11E)-11-[3-(diethylamino)propylidene]-6H-benzo[c][1]benzoxepine-2-carboxylate Traditional Name: (11E)-11-[3-(diethylamino)propylidene]-6H-benzo[c][1]benzoxepin-2-carboxylic acid methyl ester Formula: C23H27NO3 MolecularWeight: 365.46538

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCC=C1C2=CC=CC=C2COC3=C1C=C(C=C3)C(=O)OC

Isomeric SMILES

CCN(CC)CC/C=C/1\C2=CC=CC=C2COC3=C1C=C(C=C3)C(=O)OC

InChI

InChI=1S/C23H27NO3/c1-4-24(5-2)14-8-11-20-19-10-7-6-9-18(19)16-27-22-13-12-17(15-21(20)22)23(25)26-3/h6-7,9-13,15H,4-5,8,14,16H2,1-3H3/b20-11+