2-azanyl-3,5-dimethoxy-4-[(E)-3-phenylprop-2-enoyl]benzoic acid

Systemtic Name: 2-azanyl-3,5-dimethoxy-4-[(E)-3-phenylprop-2-enoyl]benzoic acid Openeye Name: 2-amino-3,5-dimethoxy-4-[(E)-3-phenylprop-2-enoyl]benzoic acid CAS Name: 2-amino-3,5-dimethoxy-4-[(E)-1-oxo-3-phenylprop-2-enyl]benzoic acid IUPAC Name: 2-amino-3,5-dimethoxy-4-[(E)-3-phenylprop-2-enoyl]benzoic acid Traditional Name: 2-amino-3,5-dimethoxy-4-[(E)-3-phenylacryloyl]benzoic acid Formula: C18H17NO5 MolecularWeight: 327.33128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C(=O)O)N)OC)C(=O)C=CC2=CC=CC=C2

Isomeric SMILES

COC1=C(C(=C(C(=C1)C(=O)O)N)OC)C(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C18H17NO5/c1-23-14-10-12(18(21)22)16(19)17(24-2)15(14)13(20)9-8-11-6-4-3-5-7-11/h3-10H,19H2,1-2H3,(H,21,22)/b9-8+