ethyl 4-azanyl-2-[3-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethoxy]-6-oxidanylidene-xanthen-9-yl]benzoate

Systemtic Name: ethyl 4-azanyl-2-[3-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethoxy]-6-oxidanylidene-xanthen-9-yl]benzoate Openeye Name: ethyl 4-amino-2-[3-(2-tert-butoxy-2-oxo-ethoxy)-6-oxo-xanthen-9-yl]benzoate CAS Name: 4-amino-2-[3-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethoxy]-6-oxo-9-xanthenyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[3-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethoxy]-6-oxoxanthen-9-yl]benzoate Traditional Name: 4-amino-2-[3-(2-tert-butoxy-2-keto-ethoxy)-6-keto-xanthen-9-yl]benzoic acid ethyl ester Formula: C28H27NO7 MolecularWeight: 489.51648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(C=C1)N)C2=C3C=CC(=O)C=C3OC4=C2C=CC(=C4)OCC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(C=C1)N)C2=C3C=CC(=O)C=C3OC4=C2C=CC(=C4)OCC(=O)OC(C)(C)C

InChI

InChI=1S/C28H27NO7/c1-5-33-27(32)19-9-6-16(29)12-22(19)26-20-10-7-17(30)13-23(20)35-24-14-18(8-11-21(24)26)34-15-25(31)36-28(2,3)4/h6-14H,5,15,29H2,1-4H3