[2-oxidanylidene-3-(propan-2-ylcarbamoyl)chromen-7-yl] 4-hexoxybenzoate

Systemtic Name: [2-oxidanylidene-3-(propan-2-ylcarbamoyl)chromen-7-yl] 4-hexoxybenzoate Openeye Name: [3-(isopropylcarbamoyl)-2-oxo-chromen-7-yl] 4-hexoxybenzoate CAS Name: 4-hexoxybenzoic acid [2-oxo-3-[oxo-(propan-2-ylamino)methyl]-1-benzopyran-7-yl] ester IUPAC Name: [2-oxo-3-(propan-2-ylcarbamoyl)chromen-7-yl] 4-hexoxybenzoate Traditional Name: 4-hexoxybenzoic acid [3-(isopropylcarbamoyl)-2-keto-chromen-7-yl] ester Formula: C26H29NO6 MolecularWeight: 451.51156

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C(=O)NC(C)C

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C(=O)NC(C)C

InChI

InChI=1S/C26H29NO6/c1-4-5-6-7-14-31-20-11-8-18(9-12-20)25(29)32-21-13-10-19-15-22(24(28)27-17(2)3)26(30)33-23(19)16-21/h8-13,15-17H,4-7,14H2,1-3H3,(H,27,28)