(2-oxidanylidene-4-propyl-chromen-7-yl) (E)-3-(4-chloranyl-3-nitro-phenyl)prop-2-enoate

Systemtic Name: (2-oxidanylidene-4-propyl-chromen-7-yl) (E)-3-(4-chloranyl-3-nitro-phenyl)prop-2-enoate Openeye Name: (2-oxo-4-propyl-chromen-7-yl) (E)-3-(4-chloro-3-nitro-phenyl)prop-2-enoate CAS Name: (E)-3-(4-chloro-3-nitrophenyl)-2-propenoic acid (2-oxo-4-propyl-1-benzopyran-7-yl) ester IUPAC Name: (2-oxo-4-propylchromen-7-yl) (E)-3-(4-chloro-3-nitrophenyl)prop-2-enoate Traditional Name: (E)-3-(4-chloro-3-nitro-phenyl)acrylic acid (2-keto-4-propyl-chromen-7-yl) ester Formula: C21H16ClNO6 MolecularWeight: 413.80784

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)C=CC3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)/C=C/C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H16ClNO6/c1-2-3-14-11-21(25)29-19-12-15(6-7-16(14)19)28-20(24)9-5-13-4-8-17(22)18(10-13)23(26)27/h4-12H,2-3H2,1H3/b9-5+