6,7-dimethyl-4-[(3-nitrophenoxy)methyl]chromen-2-one

Systemtic Name: 6,7-dimethyl-4-[(3-nitrophenoxy)methyl]chromen-2-one Openeye Name: 6,7-dimethyl-4-[(3-nitrophenoxy)methyl]chromen-2-one CAS Name: 6,7-dimethyl-4-[(3-nitrophenoxy)methyl]-1-benzopyran-2-one IUPAC Name: 6,7-dimethyl-4-[(3-nitrophenoxy)methyl]chromen-2-one Traditional Name: 6,7-dimethyl-4-[(3-nitrophenoxy)methyl]coumarin Formula: C18H15NO5 MolecularWeight: 325.3154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC3=CC=CC(=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC3=CC=CC(=C3)[N+](=O)[O-])C

InChI

InChI=1S/C18H15NO5/c1-11-6-16-13(8-18(20)24-17(16)7-12(11)2)10-23-15-5-3-4-14(9-15)19(21)22/h3-9H,10H2,1-2H3