5-[4-[6-(anthracen-2-ylamino)-6-oxidanylidene-hexoxy]phenyl]-1,2-oxazole-3-carboxylic acid

Systemtic Name: 5-[4-[6-(anthracen-2-ylamino)-6-oxidanylidene-hexoxy]phenyl]-1,2-oxazole-3-carboxylic acid Openeye Name: 5-[4-[6-(2-anthrylamino)-6-oxo-hexoxy]phenyl]isoxazole-3-carboxylic acid CAS Name: 5-[4-[6-(2-anthracenylamino)-6-oxohexoxy]phenyl]-3-isoxazolecarboxylic acid IUPAC Name: 5-[4-[6-(anthracen-2-ylamino)-6-oxohexoxy]phenyl]-1,2-oxazole-3-carboxylic acid Traditional Name: 5-[4-[6-(2-anthrylamino)-6-keto-hexoxy]phenyl]isoxazole-3-carboxylic acid Formula: C30H26N2O5 MolecularWeight: 494.53784

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C3C=C(C=CC3=CC2=C1)NC(=O)CCCCCOC4=CC=C(C=C4)C5=CC(=NO5)C(=O)O

Isomeric SMILES

C1=CC=C2C=C3C=C(C=CC3=CC2=C1)NC(=O)CCCCCOC4=CC=C(C=C4)C5=CC(=NO5)C(=O)O

InChI

InChI=1S/C30H26N2O5/c33-29(31-25-12-9-23-16-21-6-3-4-7-22(21)17-24(23)18-25)8-2-1-5-15-36-26-13-10-20(11-14-26)28-19-27(30(34)35)32-37-28/h3-4,6-7,9-14,16-19H,1-2,5,8,15H2,(H,31,33)(H,34,35)