[2-acetyloxy-4-[2-(tert-butylamino)ethanoyl]phenyl] ethanoate; ethylbenzene

Systemtic Name: [2-acetyloxy-4-[2-(tert-butylamino)ethanoyl]phenyl] ethanoate; ethylbenzene Openeye Name: [2-acetoxy-4-[2-(tert-butylamino)acetyl]phenyl] acetate; ethylbenzene CAS Name: acetic acid [2-acetyloxy-4-[2-(tert-butylamino)-1-oxoethyl]phenyl] ester; ethylbenzene IUPAC Name: [2-acetyloxy-4-[2-(tert-butylamino)acetyl]phenyl] acetate; ethylbenzene Traditional Name: acetic acid [2-acetoxy-4-[2-(tert-butylamino)acetyl]phenyl] ester; ethylbenzene Formula: C24H31NO5 MolecularWeight: 413.50664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1.CC(=O)OC1=C(C=C(C=C1)C(=O)CNC(C)(C)C)OC(=O)C

Isomeric SMILES

CCC1=CC=CC=C1.CC(=O)OC1=C(C=C(C=C1)C(=O)CNC(C)(C)C)OC(=O)C

InChI

InChI=1S/C16H21NO5.C8H10/c1-10(18)21-14-7-6-12(8-15(14)22-11(2)19)13(20)9-17-16(3,4)5;1-2-8-6-4-3-5-7-8/h6-8,17H,9H2,1-5H3;3-7H,2H2,1H3