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

Systemtic Name: 3-chloranyl-4-methyl-7-[(4-nitrophenyl)methoxy]chromen-2-one Openeye Name: 3-chloro-4-methyl-7-[(4-nitrophenyl)methoxy]chromen-2-one CAS Name: 3-chloro-4-methyl-7-[(4-nitrophenyl)methoxy]-1-benzopyran-2-one IUPAC Name: 3-chloro-4-methyl-7-[(4-nitrophenyl)methoxy]chromen-2-one Traditional Name: 3-chloro-4-methyl-7-(4-nitrobenzyl)oxy-coumarin Formula: C17H12ClNO5 MolecularWeight: 345.73388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OCC3=CC=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OCC3=CC=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H12ClNO5/c1-10-14-7-6-13(8-15(14)24-17(20)16(10)18)23-9-11-2-4-12(5-3-11)19(21)22/h2-8H,9H2,1H3