tert-butyl 4-[(3-chloranyl-4-methyl-phenyl)carbamoylamino]butanoate

Systemtic Name: tert-butyl 4-[(3-chloranyl-4-methyl-phenyl)carbamoylamino]butanoate Openeye Name: tert-butyl 4-[(3-chloro-4-methyl-phenyl)carbamoylamino]butanoate CAS Name: 4-[[(3-chloro-4-methylanilino)-oxomethyl]amino]butanoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(3-chloro-4-methylphenyl)carbamoylamino]butanoate Traditional Name: 4-[(3-chloro-4-methyl-phenyl)carbamoylamino]butyric acid tert-butyl ester Formula: C16H23ClN2O3 MolecularWeight: 326.81842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NCCCC(=O)OC(C)(C)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NCCCC(=O)OC(C)(C)C)Cl

InChI

InChI=1S/C16H23ClN2O3/c1-11-7-8-12(10-13(11)17)19-15(21)18-9-5-6-14(20)22-16(2,3)4/h7-8,10H,5-6,9H2,1-4H3,(H2,18,19,21)