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

Systemtic Name: 6-chloranyl-7-methyl-4-[[(3-nitrophenyl)amino]methyl]chromen-2-one Openeye Name: 6-chloro-7-methyl-4-[(3-nitroanilino)methyl]chromen-2-one CAS Name: 6-chloro-7-methyl-4-[(3-nitroanilino)methyl]-1-benzopyran-2-one IUPAC Name: 6-chloro-7-methyl-4-[(3-nitroanilino)methyl]chromen-2-one Traditional Name: 6-chloro-7-methyl-4-[(3-nitroanilino)methyl]coumarin Formula: C17H13ClN2O4 MolecularWeight: 344.74912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CNC3=CC(=CC=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CNC3=CC(=CC=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H13ClN2O4/c1-10-5-16-14(8-15(10)18)11(6-17(21)24-16)9-19-12-3-2-4-13(7-12)20(22)23/h2-8,19H,9H2,1H3