1-ethoxycarbonyloxyethyl 11-(4-methylpiperazin-1-yl)-6,11-dihydrobenzo[c][1]benzoxepine-2-carboxylate

Systemtic Name: 1-ethoxycarbonyloxyethyl 11-(4-methylpiperazin-1-yl)-6,11-dihydrobenzo[c][1]benzoxepine-2-carboxylate Openeye Name: 1-ethoxycarbonyloxyethyl 11-(4-methylpiperazin-1-yl)-6,11-dihydrobenzo[c][1]benzoxepine-2-carboxylate CAS Name: 11-(4-methyl-1-piperazinyl)-6,11-dihydrobenzo[c][1]benzoxepin-2-carboxylic acid 1-ethoxycarbonyloxyethyl ester IUPAC Name: 1-ethoxycarbonyloxyethyl 11-(4-methylpiperazin-1-yl)-6,11-dihydrobenzo[c][1]benzoxepine-2-carboxylate Traditional Name: 11-(4-methylpiperazino)-6,11-dihydrobenzo[c][1]benzoxepin-2-carboxylic acid 1-carbethoxyoxyethyl ester Formula: C25H30N2O6 MolecularWeight: 454.5155

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)OC(C)OC(=O)C1=CC2=C(C=C1)OCC3=CC=CC=C3C2N4CCN(CC4)C

Isomeric SMILES

CCOC(=O)OC(C)OC(=O)C1=CC2=C(C=C1)OCC3=CC=CC=C3C2N4CCN(CC4)C

InChI

InChI=1S/C25H30N2O6/c1-4-30-25(29)33-17(2)32-24(28)18-9-10-22-21(15-18)23(27-13-11-26(3)12-14-27)20-8-6-5-7-19(20)16-31-22/h5-10,15,17,23H,4,11-14,16H2,1-3H3