4,4-dimethylpentyl 3-azanyl-3-phenyl-propanoate

Systemtic Name: 4,4-dimethylpentyl 3-azanyl-3-phenyl-propanoate Openeye Name: 4,4-dimethylpentyl 3-amino-3-phenyl-propanoate CAS Name: 3-amino-3-phenylpropanoic acid 4,4-dimethylpentyl ester IUPAC Name: 4,4-dimethylpentyl 3-amino-3-phenylpropanoate Traditional Name: 3-amino-3-phenyl-propionic acid 4,4-dimethylpentyl ester Formula: C16H25NO2 MolecularWeight: 263.3752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CCCOC(=O)CC(C1=CC=CC=C1)N

Isomeric SMILES

CC(C)(C)CCCOC(=O)CC(C1=CC=CC=C1)N

InChI

InChI=1S/C16H25NO2/c1-16(2,3)10-7-11-19-15(18)12-14(17)13-8-5-4-6-9-13/h4-6,8-9,14H,7,10-12,17H2,1-3H3