4-methyl-7-[2-(3-nitrophenyl)-2-oxidanylidene-ethoxy]-3-(phenylmethyl)chromen-2-one

Systemtic Name: 4-methyl-7-[2-(3-nitrophenyl)-2-oxidanylidene-ethoxy]-3-(phenylmethyl)chromen-2-one Openeye Name: 3-benzyl-4-methyl-7-[2-(3-nitrophenyl)-2-oxo-ethoxy]chromen-2-one CAS Name: 4-methyl-7-[2-(3-nitrophenyl)-2-oxoethoxy]-3-(phenylmethyl)-1-benzopyran-2-one IUPAC Name: 3-benzyl-4-methyl-7-[2-(3-nitrophenyl)-2-oxoethoxy]chromen-2-one Traditional Name: 3-benzyl-7-[2-keto-2-(3-nitrophenyl)ethoxy]-4-methyl-coumarin Formula: C25H19NO6 MolecularWeight: 429.42146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OCC(=O)C3=CC(=CC=C3)[N+](=O)[O-])CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OCC(=O)C3=CC(=CC=C3)[N+](=O)[O-])CC4=CC=CC=C4

InChI

InChI=1S/C25H19NO6/c1-16-21-11-10-20(31-15-23(27)18-8-5-9-19(13-18)26(29)30)14-24(21)32-25(28)22(16)12-17-6-3-2-4-7-17/h2-11,13-14H,12,15H2,1H3