oxan-4-yl 3-[4-(6H-benzo[c][1]benzoxepin-11-ylidene)piperidin-1-yl]propanoate

Systemtic Name: oxan-4-yl 3-[4-(6H-benzo[c][1]benzoxepin-11-ylidene)piperidin-1-yl]propanoate Openeye Name: tetrahydropyran-4-yl 3-[4-(6H-benzo[c][1]benzoxepin-11-ylidene)-1-piperidyl]propanoate CAS Name: 3-[4-(6H-benzo[c][1]benzoxepin-11-ylidene)-1-piperidinyl]propanoic acid 4-oxanyl ester IUPAC Name: oxan-4-yl 3-[4-(6H-benzo[c][1]benzoxepin-11-ylidene)piperidin-1-yl]propanoate Traditional Name: 3-[4-(6H-benzo[c][1]benzoxepin-11-ylidene)piperidino]propionic acid tetrahydropyran-4-yl ester Formula: C27H31NO4 MolecularWeight: 433.53934

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1OC(=O)CCN2CCC(=C3C4=CC=CC=C4COC5=CC=CC=C53)CC2

Isomeric SMILES

C1COCCC1OC(=O)CCN2CCC(=C3C4=CC=CC=C4COC5=CC=CC=C53)CC2

InChI

InChI=1S/C27H31NO4/c29-26(32-22-12-17-30-18-13-22)11-16-28-14-9-20(10-15-28)27-23-6-2-1-5-21(23)19-31-25-8-4-3-7-24(25)27/h1-8,22H,9-19H2