prop-2-enyl (2Z)-4-[4-(imidazol-1-ylmethyl)phenyl]-2-[(3-nitrophenyl)methylidene]-3-oxidanylidene-butanoate

Systemtic Name: prop-2-enyl (2Z)-4-[4-(imidazol-1-ylmethyl)phenyl]-2-[(3-nitrophenyl)methylidene]-3-oxidanylidene-butanoate Openeye Name: allyl (2Z)-4-[4-(imidazol-1-ylmethyl)phenyl]-2-[(3-nitrophenyl)methylene]-3-oxo-butanoate CAS Name: (2Z)-4-[4-(1-imidazolylmethyl)phenyl]-2-[(3-nitrophenyl)methylidene]-3-oxobutanoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (2Z)-4-[4-(imidazol-1-ylmethyl)phenyl]-2-[(3-nitrophenyl)methylidene]-3-oxobutanoate Traditional Name: (Z)-2-[2-[4-(imidazol-1-ylmethyl)phenyl]acetyl]-3-(3-nitrophenyl)acrylic acid allyl ester Formula: C24H21N3O5 MolecularWeight: 431.44064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)C(=CC1=CC(=CC=C1)[N+](=O)[O-])C(=O)CC2=CC=C(C=C2)CN3C=CN=C3

Isomeric SMILES

C=CCOC(=O)/C(=C\C1=CC(=CC=C1)[N+](=O)[O-])/C(=O)CC2=CC=C(C=C2)CN3C=CN=C3

InChI

InChI=1S/C24H21N3O5/c1-2-12-32-24(29)22(14-20-4-3-5-21(13-20)27(30)31)23(28)15-18-6-8-19(9-7-18)16-26-11-10-25-17-26/h2-11,13-14,17H,1,12,15-16H2/b22-14-