1-butyl-7-nitro-2-oxidanyl-3-prop-2-enoxy-quinolin-4-one

Systemtic Name: 1-butyl-7-nitro-2-oxidanyl-3-prop-2-enoxy-quinolin-4-one Openeye Name: 3-allyloxy-1-butyl-2-hydroxy-7-nitro-quinolin-4-one CAS Name: 1-butyl-2-hydroxy-7-nitro-3-prop-2-enoxy-4-quinolinone IUPAC Name: 1-butyl-2-hydroxy-7-nitro-3-prop-2-enoxyquinolin-4-one Traditional Name: 3-allyloxy-1-butyl-2-hydroxy-7-nitro-4-quinolone Formula: C16H18N2O5 MolecularWeight: 318.32452

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=CC(=C2)[N+](=O)[O-])C(=O)C(=C1O)OCC=C

Isomeric SMILES

CCCCN1C2=C(C=CC(=C2)[N+](=O)[O-])C(=O)C(=C1O)OCC=C

InChI

InChI=1S/C16H18N2O5/c1-3-5-8-17-13-10-11(18(21)22)6-7-12(13)14(19)15(16(17)20)23-9-4-2/h4,6-7,10,20H,2-3,5,8-9H2,1H3