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

Systemtic Name: [2-oxidanylidene-3-(propan-2-ylcarbamoyl)chromen-7-yl] 4-nitrobenzoate Openeye Name: [3-(isopropylcarbamoyl)-2-oxo-chromen-7-yl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic 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-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [3-(isopropylcarbamoyl)-2-keto-chromen-7-yl] ester Formula: C20H16N2O7 MolecularWeight: 396.35024

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CC2=C(C=C(C=C2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-])OC1=O

Isomeric SMILES

CC(C)NC(=O)C1=CC2=C(C=C(C=C2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-])OC1=O

InChI

InChI=1S/C20H16N2O7/c1-11(2)21-18(23)16-9-13-5-8-15(10-17(13)29-20(16)25)28-19(24)12-3-6-14(7-4-12)22(26)27/h3-11H,1-2H3,(H,21,23)