3-[(10-acetyloxy-1,2,3-trimethoxy-9-oxidanylidene-6,7-dihydro-5H-benzo[a]heptalen-7-yl)amino]propanoic acid

Systemtic Name: 3-[(10-acetyloxy-1,2,3-trimethoxy-9-oxidanylidene-6,7-dihydro-5H-benzo[a]heptalen-7-yl)amino]propanoic acid Openeye Name: 3-[(10-acetoxy-1,2,3-trimethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl)amino]propanoic acid CAS Name: 3-[(10-acetyloxy-1,2,3-trimethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl)amino]propanoic acid IUPAC Name: 3-[(10-acetyloxy-1,2,3-trimethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl)amino]propanoic acid Traditional Name: 3-[(10-acetoxy-9-keto-1,2,3-trimethoxy-6,7-dihydro-5H-benzo[a]heptalen-7-yl)amino]propionic acid Formula: C24H27NO8 MolecularWeight: 457.47308

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C2C(=CC1=O)C(CCC3=CC(=C(C(=C32)OC)OC)OC)NCCC(=O)O

Isomeric SMILES

CC(=O)OC1=CC=C2C(=CC1=O)C(CCC3=CC(=C(C(=C32)OC)OC)OC)NCCC(=O)O

InChI

InChI=1S/C24H27NO8/c1-13(26)33-19-8-6-15-16(12-18(19)27)17(25-10-9-21(28)29)7-5-14-11-20(30-2)23(31-3)24(32-4)22(14)15/h6,8,11-12,17,25H,5,7,9-10H2,1-4H3,(H,28,29)