ethyl 3-(3,4-dihydro-2H-chromen-4-ylcarbamoyl)-5-nitro-benzoate

Systemtic Name: ethyl 3-(3,4-dihydro-2H-chromen-4-ylcarbamoyl)-5-nitro-benzoate Openeye Name: ethyl 3-(chroman-4-ylcarbamoyl)-5-nitro-benzoate CAS Name: 3-[(3,4-dihydro-2H-1-benzopyran-4-ylamino)-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-(3,4-dihydro-2H-chromen-4-ylcarbamoyl)-5-nitrobenzoate Traditional Name: 3-(chroman-4-ylcarbamoyl)-5-nitro-benzoic acid ethyl ester Formula: C19H18N2O6 MolecularWeight: 370.35602

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2CCOC3=CC=CC=C23)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2CCOC3=CC=CC=C23)[N+](=O)[O-]

InChI

InChI=1S/C19H18N2O6/c1-2-26-19(23)13-9-12(10-14(11-13)21(24)25)18(22)20-16-7-8-27-17-6-4-3-5-15(16)17/h3-6,9-11,16H,2,7-8H2,1H3,(H,20,22)