O5-phenyl O1-(phenylmethyl) (Z)-3,4-diethyl-2-nitro-pent-2-enedioate

Systemtic Name: O5-phenyl O1-(phenylmethyl) (Z)-3,4-diethyl-2-nitro-pent-2-enedioate Openeye Name: O1-benzyl O5-phenyl (Z)-3,4-diethyl-2-nitro-pent-2-enedioate CAS Name: (Z)-3,4-diethyl-2-nitro-2-pentenedioic acid O5-phenyl ester O1-(phenylmethyl) ester IUPAC Name: 1-O-benzyl 5-O-phenyl (Z)-3,4-diethyl-2-nitropent-2-enedioate Traditional Name: (Z)-3,4-diethyl-2-nitro-pent-2-enedioic acid O1-benzyl ester O5-phenyl ester Formula: C22H23NO6 MolecularWeight: 397.42112

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=C(C(=O)OCC1=CC=CC=C1)[N+](=O)[O-])CC)C(=O)OC2=CC=CC=C2

Isomeric SMILES

CCC(/C(=C(/C(=O)OCC1=CC=CC=C1)\[N+](=O)[O-])/CC)C(=O)OC2=CC=CC=C2

InChI

InChI=1S/C22H23NO6/c1-3-18(19(4-2)21(24)29-17-13-9-6-10-14-17)20(23(26)27)22(25)28-15-16-11-7-5-8-12-16/h5-14,19H,3-4,15H2,1-2H3/b20-18-