8-[[(1S,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methyliminomethyl]-4H-1,3-benzodioxine-6-carboxylic acid

Systemtic Name: 8-[[(1S,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methyliminomethyl]-4H-1,3-benzodioxine-6-carboxylic acid Openeye Name: 8-[[(1S,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methyliminomethyl]-4H-1,3-benzodioxine-6-carboxylic acid CAS Name: 8-[[(1S,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methyliminomethyl]-4H-1,3-benzodioxin-6-carboxylic acid IUPAC Name: 8-[[(1S,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methyliminomethyl]-4H-1,3-benzodioxine-6-carboxylic acid Traditional Name: 8-[[(1S,9aR)-quinolizidin-1-yl]methyliminomethyl]-4H-1,3-benzodioxin-6-carboxylic acid Formula: C20H26N2O4 MolecularWeight: 358.43144

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN2CCCC(C2C1)CN=CC3=C4C(=CC(=C3)C(=O)O)COCO4

Isomeric SMILES

C1CCN2CCC[C@H]([C@H]2C1)CN=CC3=C4C(=CC(=C3)C(=O)O)COCO4

InChI

InChI=1S/C20H26N2O4/c23-20(24)15-8-16(19-17(9-15)12-25-13-26-19)11-21-10-14-4-3-7-22-6-2-1-5-18(14)22/h8-9,11,14,18H,1-7,10,12-13H2,(H,23,24)/t14-,18+/m0/s1