[4-[2,3-bis(azanyl)-3-oxidanylidene-propyl]phenyl] 2-methylprop-2-enoate

Systemtic Name: [4-[2,3-bis(azanyl)-3-oxidanylidene-propyl]phenyl] 2-methylprop-2-enoate Openeye Name: [4-(2,3-diamino-3-oxo-propyl)phenyl] 2-methylprop-2-enoate CAS Name: 2-methyl-2-propenoic acid [4-(2,3-diamino-3-oxopropyl)phenyl] ester IUPAC Name: [4-(2,3-diamino-3-oxopropyl)phenyl] 2-methylprop-2-enoate Traditional Name: 2-methylacrylic acid [4-(2,3-diamino-3-keto-propyl)phenyl] ester Formula: C13H16N2O3 MolecularWeight: 248.27774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=O)OC1=CC=C(C=C1)CC(C(=O)N)N

Isomeric SMILES

CC(=C)C(=O)OC1=CC=C(C=C1)CC(C(=O)N)N

InChI

InChI=1S/C13H16N2O3/c1-8(2)13(17)18-10-5-3-9(4-6-10)7-11(14)12(15)16/h3-6,11H,1,7,14H2,2H3,(H2,15,16)