[1,3-bis[(4-aminophenyl)carbonyloxy]-2-(2-oxidanylidenechromen-3-yl)carbonyloxy-butan-2-yl] 2-oxidanylidenechromene-3-carboxylate

Systemtic Name: [1,3-bis[(4-aminophenyl)carbonyloxy]-2-(2-oxidanylidenechromen-3-yl)carbonyloxy-butan-2-yl] 2-oxidanylidenechromene-3-carboxylate Openeye Name: [2-(4-aminobenzoyl)oxy-1-[(4-aminobenzoyl)oxymethyl]-1-(2-oxochromene-3-carbonyl)oxy-propyl] 2-oxochromene-3-carboxylate CAS Name: 2-oxo-1-benzopyran-3-carboxylic acid [1,3-bis[(4-aminophenyl)-oxomethoxy]-2-[oxo-(2-oxo-1-benzopyran-3-yl)methoxy]butan-2-yl] ester IUPAC Name: [1,3-bis[(4-aminobenzoyl)oxy]-2-(2-oxochromene-3-carbonyl)oxybutan-2-yl] 2-oxochromene-3-carboxylate Traditional Name: 2-ketochromene-3-carboxylic acid [2-(4-aminobenzoyl)oxy-1-[(4-aminobenzoyl)oxymethyl]-1-(2-ketochromene-3-carbonyl)oxy-propyl] ester Formula: C38H28N2O12 MolecularWeight: 704.63512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(COC(=O)C1=CC=C(C=C1)N)(OC(=O)C2=CC3=CC=CC=C3OC2=O)OC(=O)C4=CC5=CC=CC=C5OC4=O)OC(=O)C6=CC=C(C=C6)N

Isomeric SMILES

CC(C(COC(=O)C1=CC=C(C=C1)N)(OC(=O)C2=CC3=CC=CC=C3OC2=O)OC(=O)C4=CC5=CC=CC=C5OC4=O)OC(=O)C6=CC=C(C=C6)N

InChI

InChI=1S/C38H28N2O12/c1-21(48-33(42)23-12-16-27(40)17-13-23)38(20-47-32(41)22-10-14-26(39)15-11-22,51-36(45)28-18-24-6-2-4-8-30(24)49-34(28)43)52-37(46)29-19-25-7-3-5-9-31(25)50-35(29)44/h2-19,21H,20,39-40H2,1H3