ethyl 3-[(4-bromophenyl)methylamino]-4-methyl-pentanoate

Systemtic Name: ethyl 3-[(4-bromophenyl)methylamino]-4-methyl-pentanoate Openeye Name: ethyl 3-[(4-bromophenyl)methylamino]-4-methyl-pentanoate CAS Name: 3-[(4-bromophenyl)methylamino]-4-methylpentanoic acid ethyl ester IUPAC Name: ethyl 3-[(4-bromophenyl)methylamino]-4-methylpentanoate Traditional Name: 3-[(4-bromobenzyl)amino]-4-methyl-valeric acid ethyl ester Formula: C15H22BrNO2 MolecularWeight: 328.24468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C(C)C)NCC1=CC=C(C=C1)Br

Isomeric SMILES

CCOC(=O)CC(C(C)C)NCC1=CC=C(C=C1)Br

InChI

InChI=1S/C15H22BrNO2/c1-4-19-15(18)9-14(11(2)3)17-10-12-5-7-13(16)8-6-12/h5-8,11,14,17H,4,9-10H2,1-3H3