O1-ethyl O3-[3-[[(E)-tetradec-4-enyl]amino]phenyl]carbonyl 2-tert-butylpropanedioate

Systemtic Name: O1-ethyl O3-[3-[[(E)-tetradec-4-enyl]amino]phenyl]carbonyl 2-tert-butylpropanedioate Openeye Name: O1-ethyl O3-[3-[[(E)-tetradec-4-enyl]amino]benzoyl] 2-tert-butylpropanedioate CAS Name: 2-tert-butylpropanedioic acid O1-ethyl ester O3-[oxo-[3-[[(E)-tetradec-4-enyl]amino]phenyl]methyl] ester IUPAC Name: 1-O-ethyl 3-O-[3-[[(E)-tetradec-4-enyl]amino]benzoyl] 2-tert-butylpropanedioate Traditional Name: 2-tert-butylmalonic acid O1-ethyl ester O3-[3-[[(E)-tetradec-4-enyl]amino]benzoyl] ester Formula: C30H47NO5 MolecularWeight: 501.69788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC=CCCCNC1=CC=CC(=C1)C(=O)OC(=O)C(C(=O)OCC)C(C)(C)C

Isomeric SMILES

CCCCCCCCC/C=C/CCCNC1=CC=CC(=C1)C(=O)OC(=O)C(C(=O)OCC)C(C)(C)C

InChI

InChI=1S/C30H47NO5/c1-6-8-9-10-11-12-13-14-15-16-17-18-22-31-25-21-19-20-24(23-25)27(32)36-29(34)26(30(3,4)5)28(33)35-7-2/h15-16,19-21,23,26,31H,6-14,17-18,22H2,1-5H3/b16-15+