4-[[(3-nitrophenyl)amino]methyl]-7-oxidanyl-chromen-2-one

Systemtic Name: 4-[[(3-nitrophenyl)amino]methyl]-7-oxidanyl-chromen-2-one Openeye Name: 7-hydroxy-4-[(3-nitroanilino)methyl]chromen-2-one CAS Name: 7-hydroxy-4-[(3-nitroanilino)methyl]-1-benzopyran-2-one IUPAC Name: 7-hydroxy-4-[(3-nitroanilino)methyl]chromen-2-one Traditional Name: 7-hydroxy-4-[(3-nitroanilino)methyl]coumarin Formula: C16H12N2O5 MolecularWeight: 312.27688

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])NCC2=CC(=O)OC3=C2C=CC(=C3)O

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])NCC2=CC(=O)OC3=C2C=CC(=C3)O

InChI

InChI=1S/C16H12N2O5/c19-13-4-5-14-10(6-16(20)23-15(14)8-13)9-17-11-2-1-3-12(7-11)18(21)22/h1-8,17,19H,9H2