5-[4-(dimethylaminomethyl)phenyl]-6-nitro-chromen-2-one

Systemtic Name: 5-[4-(dimethylaminomethyl)phenyl]-6-nitro-chromen-2-one Openeye Name: 5-[4-(dimethylaminomethyl)phenyl]-6-nitro-chromen-2-one CAS Name: 5-[4-(dimethylaminomethyl)phenyl]-6-nitro-1-benzopyran-2-one IUPAC Name: 5-[4-(dimethylaminomethyl)phenyl]-6-nitrochromen-2-one Traditional Name: 5-[4-(dimethylaminomethyl)phenyl]-6-nitro-coumarin Formula: C18H16N2O4 MolecularWeight: 324.33064

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=C(C=C1)C2=C(C=CC3=C2C=CC(=O)O3)[N+](=O)[O-]

Isomeric SMILES

CN(C)CC1=CC=C(C=C1)C2=C(C=CC3=C2C=CC(=O)O3)[N+](=O)[O-]

InChI

InChI=1S/C18H16N2O4/c1-19(2)11-12-3-5-13(6-4-12)18-14-7-10-17(21)24-16(14)9-8-15(18)20(22)23/h3-10H,11H2,1-2H3