4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-3-methoxy-7-nitro-1-octyl-quinolin-2-one

Systemtic Name: 4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-3-methoxy-7-nitro-1-octyl-quinolin-2-one Openeye Name: 4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-3-methoxy-7-nitro-1-octyl-quinolin-2-one CAS Name: 4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-3-methoxy-7-nitro-1-octyl-2-quinolinone IUPAC Name: 4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-3-methoxy-7-nitro-1-octylquinolin-2-one Traditional Name: 4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-3-methoxy-7-nitro-1-octyl-carbostyril Formula: C28H40N2O5 MolecularWeight: 484.6276

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C2=C(C=CC(=C2)[N+](=O)[O-])C(=C(C1=O)OC)OCC=C(C)CCC=C(C)C

Isomeric SMILES

CCCCCCCCN1C2=C(C=CC(=C2)[N+](=O)[O-])C(=C(C1=O)OC)OC/C=C(\C)/CCC=C(C)C

InChI

InChI=1S/C28H40N2O5/c1-6-7-8-9-10-11-18-29-25-20-23(30(32)33)15-16-24(25)26(27(34-5)28(29)31)35-19-17-22(4)14-12-13-21(2)3/h13,15-17,20H,6-12,14,18-19H2,1-5H3/b22-17+