butyl (E)-3-[8-(1,3-dioxolan-2-yl)-3-nitro-quinolin-6-yl]prop-2-enoate

Systemtic Name: butyl (E)-3-[8-(1,3-dioxolan-2-yl)-3-nitro-quinolin-6-yl]prop-2-enoate Openeye Name: butyl (E)-3-[8-(1,3-dioxolan-2-yl)-3-nitro-6-quinolyl]prop-2-enoate CAS Name: (E)-3-[8-(1,3-dioxolan-2-yl)-3-nitro-6-quinolinyl]-2-propenoic acid butyl ester IUPAC Name: butyl (E)-3-[8-(1,3-dioxolan-2-yl)-3-nitroquinolin-6-yl]prop-2-enoate Traditional Name: (E)-3-[8-(1,3-dioxolan-2-yl)-3-nitro-6-quinolyl]acrylic acid butyl ester Formula: C19H20N2O6 MolecularWeight: 372.3719

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C=CC1=CC(=C2C(=C1)C=C(C=N2)[N+](=O)[O-])C3OCCO3

Isomeric SMILES

CCCCOC(=O)/C=C/C1=CC(=C2C(=C1)C=C(C=N2)[N+](=O)[O-])C3OCCO3

InChI

InChI=1S/C19H20N2O6/c1-2-3-6-25-17(22)5-4-13-9-14-11-15(21(23)24)12-20-18(14)16(10-13)19-26-7-8-27-19/h4-5,9-12,19H,2-3,6-8H2,1H3/b5-4+