[3-[[(E)-but-2-enoyl]amino]phenyl] N-(2,6-diethylcyclohexyl)carbamate

Systemtic Name: [3-[[(E)-but-2-enoyl]amino]phenyl] N-(2,6-diethylcyclohexyl)carbamate Openeye Name: [3-[[(E)-but-2-enoyl]amino]phenyl] N-(2,6-diethylcyclohexyl)carbamate CAS Name: N-(2,6-diethylcyclohexyl)carbamic acid [3-[[(E)-1-oxobut-2-enyl]amino]phenyl] ester IUPAC Name: [3-[[(E)-but-2-enoyl]amino]phenyl] N-(2,6-diethylcyclohexyl)carbamate Traditional Name: N-(2,6-diethylcyclohexyl)carbamic acid [3-[[(E)-but-2-enoyl]amino]phenyl] ester Formula: C21H30N2O3 MolecularWeight: 358.4745

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC(C1NC(=O)OC2=CC=CC(=C2)NC(=O)C=CC)CC

Isomeric SMILES

CCC1CCCC(C1NC(=O)OC2=CC=CC(=C2)NC(=O)/C=C/C)CC

InChI

InChI=1S/C21H30N2O3/c1-4-9-19(24)22-17-12-8-13-18(14-17)26-21(25)23-20-15(5-2)10-7-11-16(20)6-3/h4,8-9,12-16,20H,5-7,10-11H2,1-3H3,(H,22,24)(H,23,25)/b9-4+