4-[[(2-chloranyl-5-nitro-phenyl)methyl-methyl-amino]methyl]-8-methyl-7-oxidanyl-chromen-2-one

Systemtic Name: 4-[[(2-chloranyl-5-nitro-phenyl)methyl-methyl-amino]methyl]-8-methyl-7-oxidanyl-chromen-2-one Openeye Name: 4-[[(2-chloro-5-nitro-phenyl)methyl-methyl-amino]methyl]-7-hydroxy-8-methyl-chromen-2-one CAS Name: 4-[[(2-chloro-5-nitrophenyl)methyl-methylamino]methyl]-7-hydroxy-8-methyl-1-benzopyran-2-one IUPAC Name: 4-[[(2-chloro-5-nitrophenyl)methyl-methylamino]methyl]-7-hydroxy-8-methylchromen-2-one Traditional Name: 4-[[(2-chloro-5-nitro-benzyl)-methyl-amino]methyl]-7-hydroxy-8-methyl-coumarin Formula: C19H17ClN2O5 MolecularWeight: 388.80168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2CN(C)CC3=C(C=CC(=C3)[N+](=O)[O-])Cl)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2CN(C)CC3=C(C=CC(=C3)[N+](=O)[O-])Cl)O

InChI

InChI=1S/C19H17ClN2O5/c1-11-17(23)6-4-15-12(8-18(24)27-19(11)15)9-21(2)10-13-7-14(22(25)26)3-5-16(13)20/h3-8,23H,9-10H2,1-2H3