tert-butyl N-[4-[2-(3-imidazol-1-ylpropylamino)-2-oxidanylidene-ethyl]phenyl]carbamate

Systemtic Name: tert-butyl N-[4-[2-(3-imidazol-1-ylpropylamino)-2-oxidanylidene-ethyl]phenyl]carbamate Openeye Name: tert-butyl N-[4-[2-(3-imidazol-1-ylpropylamino)-2-oxo-ethyl]phenyl]carbamate CAS Name: N-[4-[2-[3-(1-imidazolyl)propylamino]-2-oxoethyl]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[2-(3-imidazol-1-ylpropylamino)-2-oxoethyl]phenyl]carbamate Traditional Name: N-[4-[2-(3-imidazol-1-ylpropylamino)-2-keto-ethyl]phenyl]carbamic acid tert-butyl ester Formula: C19H26N4O3 MolecularWeight: 358.43474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=C(C=C1)CC(=O)NCCCN2C=CN=C2

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=C(C=C1)CC(=O)NCCCN2C=CN=C2

InChI

InChI=1S/C19H26N4O3/c1-19(2,3)26-18(25)22-16-7-5-15(6-8-16)13-17(24)21-9-4-11-23-12-10-20-14-23/h5-8,10,12,14H,4,9,11,13H2,1-3H3,(H,21,24)(H,22,25)