8-methyl-4-[[(2-methyl-3-nitro-phenyl)amino]methyl]-7-oxidanyl-chromen-2-one

Systemtic Name: 8-methyl-4-[[(2-methyl-3-nitro-phenyl)amino]methyl]-7-oxidanyl-chromen-2-one Openeye Name: 7-hydroxy-8-methyl-4-[(2-methyl-3-nitro-anilino)methyl]chromen-2-one CAS Name: 7-hydroxy-8-methyl-4-[(2-methyl-3-nitroanilino)methyl]-1-benzopyran-2-one IUPAC Name: 7-hydroxy-8-methyl-4-[(2-methyl-3-nitroanilino)methyl]chromen-2-one Traditional Name: 7-hydroxy-8-methyl-4-[(2-methyl-3-nitro-anilino)methyl]coumarin Formula: C18H16N2O5 MolecularWeight: 340.33004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NCC2=CC(=O)OC3=C2C=CC(=C3C)O

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NCC2=CC(=O)OC3=C2C=CC(=C3C)O

InChI

InChI=1S/C18H16N2O5/c1-10-14(4-3-5-15(10)20(23)24)19-9-12-8-17(22)25-18-11(2)16(21)7-6-13(12)18/h3-8,19,21H,9H2,1-2H3