[(E)-4-[[(2E,4E)-hexa-2,4-dienoyl]amino]but-3-enyl] 2-methoxybenzoate

Systemtic Name: [(E)-4-[[(2E,4E)-hexa-2,4-dienoyl]amino]but-3-enyl] 2-methoxybenzoate Openeye Name: [(E)-4-[[(2E,4E)-hexa-2,4-dienoyl]amino]but-3-enyl] 2-methoxybenzoate CAS Name: 2-methoxybenzoic acid [(E)-4-[[(2E,4E)-1-oxohexa-2,4-dienyl]amino]but-3-enyl] ester IUPAC Name: [(E)-4-[[(2E,4E)-hexa-2,4-dienoyl]amino]but-3-enyl] 2-methoxybenzoate Traditional Name: 2-methoxybenzoic acid [(E)-4-[[(2E,4E)-hexa-2,4-dienoyl]amino]but-3-enyl] ester Formula: C18H21NO4 MolecularWeight: 315.36364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=CC=CC(=O)NC=CCCOC(=O)C1=CC=CC=C1OC

Isomeric SMILES

C/C=C/C=C/C(=O)N/C=C/CCOC(=O)C1=CC=CC=C1OC

InChI

InChI=1S/C18H21NO4/c1-3-4-5-12-17(20)19-13-8-9-14-23-18(21)15-10-6-7-11-16(15)22-2/h3-8,10-13H,9,14H2,1-2H3,(H,19,20)/b4-3+,12-5+,13-8+