(2-oxidanylidene-4-propan-2-yl-chromen-7-yl) (E)-3-(3-nitrophenyl)prop-2-enoate

Systemtic Name: (2-oxidanylidene-4-propan-2-yl-chromen-7-yl) (E)-3-(3-nitrophenyl)prop-2-enoate Openeye Name: (4-isopropyl-2-oxo-chromen-7-yl) (E)-3-(3-nitrophenyl)prop-2-enoate CAS Name: (E)-3-(3-nitrophenyl)-2-propenoic acid (2-oxo-4-propan-2-yl-1-benzopyran-7-yl) ester IUPAC Name: (2-oxo-4-propan-2-ylchromen-7-yl) (E)-3-(3-nitrophenyl)prop-2-enoate Traditional Name: (E)-3-(3-nitrophenyl)acrylic acid (4-isopropyl-2-keto-chromen-7-yl) ester Formula: C21H17NO6 MolecularWeight: 379.36278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=O)OC2=C1C=CC(=C2)OC(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC(=O)OC2=C1C=CC(=C2)OC(=O)/C=C/C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H17NO6/c1-13(2)18-12-21(24)28-19-11-16(7-8-17(18)19)27-20(23)9-6-14-4-3-5-15(10-14)22(25)26/h3-13H,1-2H3/b9-6+