[2-(acetyloxymethyl)-3-methyl-7-oxidanylidene-pyrano[3,2-e]indol-1-yl]methyl 3-chloranylbenzoate

Systemtic Name: [2-(acetyloxymethyl)-3-methyl-7-oxidanylidene-pyrano[3,2-e]indol-1-yl]methyl 3-chloranylbenzoate Openeye Name: [2-(acetoxymethyl)-3-methyl-7-oxo-pyrano[3,2-e]indol-1-yl]methyl 3-chlorobenzoate CAS Name: 3-chlorobenzoic acid [2-(acetyloxymethyl)-3-methyl-7-oxo-1-pyrano[3,2-e]indolyl]methyl ester IUPAC Name: [2-(acetyloxymethyl)-3-methyl-7-oxopyrano[3,2-e]indol-1-yl]methyl 3-chlorobenzoate Traditional Name: 3-chlorobenzoic acid [2-(acetoxymethyl)-7-keto-3-methyl-pyran[3,2-e]indol-1-yl]methyl ester Formula: C23H18ClNO6 MolecularWeight: 439.84512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=C(C2=C(N1C)C=CC3=C2C=CC(=O)O3)COC(=O)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC(=O)OCC1=C(C2=C(N1C)C=CC3=C2C=CC(=O)O3)COC(=O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C23H18ClNO6/c1-13(26)29-12-19-17(11-30-23(28)14-4-3-5-15(24)10-14)22-16-6-9-21(27)31-20(16)8-7-18(22)25(19)2/h3-10H,11-12H2,1-2H3