cyclopentyl 3-[4-(6H-benzo[c][1]benzoxepin-11-ylidene)piperidin-1-yl]propanoate; ethanedioic acid

Systemtic Name: cyclopentyl 3-[4-(6H-benzo[c][1]benzoxepin-11-ylidene)piperidin-1-yl]propanoate; ethanedioic acid Openeye Name: cyclopentyl 3-[4-(6H-benzo[c][1]benzoxepin-11-ylidene)-1-piperidyl]propanoate; oxalic acid CAS Name: 3-[4-(6H-benzo[c][1]benzoxepin-11-ylidene)-1-piperidinyl]propanoic acid cyclopentyl ester; oxalic acid IUPAC Name: cyclopentyl 3-[4-(6H-benzo[c][1]benzoxepin-11-ylidene)piperidin-1-yl]propanoate; oxalic acid Traditional Name: 3-[4-(6H-benzo[c][1]benzoxepin-11-ylidene)piperidino]propionic acid cyclopentyl ester; oxalic acid Formula: C29H33NO7 MolecularWeight: 507.57482

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)OC(=O)CCN2CCC(=C3C4=CC=CC=C4COC5=CC=CC=C53)CC2.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCC(C1)OC(=O)CCN2CCC(=C3C4=CC=CC=C4COC5=CC=CC=C53)CC2.C(=O)(C(=O)O)O

InChI

InChI=1S/C27H31NO3.C2H2O4/c29-26(31-22-8-2-3-9-22)15-18-28-16-13-20(14-17-28)27-23-10-4-1-7-21(23)19-30-25-12-6-5-11-24(25)27;3-1(4)2(5)6/h1,4-7,10-12,22H,2-3,8-9,13-19H2;(H,3,4)(H,5,6)