(Z)-but-2-enedioic acid; 1-(6,11-dihydrobenzo[c][1]benzoxepin-11-yl)-4-methyl-piperazine

Systemtic Name: (Z)-but-2-enedioic acid; 1-(6,11-dihydrobenzo[c][1]benzoxepin-11-yl)-4-methyl-piperazine Openeye Name: 1-(6,11-dihydrobenzo[c][1]benzoxepin-11-yl)-4-methyl-piperazine; maleic acid CAS Name: (Z)-2-butenedioic acid; 1-(6,11-dihydrobenzo[c][1]benzoxepin-11-yl)-4-methylpiperazine IUPAC Name: (Z)-but-2-enedioic acid; 1-(6,11-dihydrobenzo[c][1]benzoxepin-11-yl)-4-methylpiperazine Traditional Name: 1-(6,11-dihydrobenzo[c][1]benzoxepin-11-yl)-4-methyl-piperazine; maleic acid Formula: C23H26N2O5 MolecularWeight: 410.46294

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2C3=CC=CC=C3COC4=CC=CC=C24.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CN1CCN(CC1)C2C3=CC=CC=C3COC4=CC=CC=C24.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C19H22N2O.C4H4O4/c1-20-10-12-21(13-11-20)19-16-7-3-2-6-15(16)14-22-18-9-5-4-8-17(18)19;5-3(6)1-2-4(7)8/h2-9,19H,10-14H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-