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

Systemtic Name: methyl 3-[(3-bromophenyl)methylamino]-4-methyl-pentanoate Openeye Name: methyl 3-[(3-bromophenyl)methylamino]-4-methyl-pentanoate CAS Name: 3-[(3-bromophenyl)methylamino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 3-[(3-bromophenyl)methylamino]-4-methylpentanoate Traditional Name: 3-[(3-bromobenzyl)amino]-4-methyl-valeric acid methyl ester Formula: C14H20BrNO2 MolecularWeight: 314.2181

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20BrNO2/c1-10(2)13(8-14(17)18-3)16-9-11-5-4-6-12(15)7-11/h4-7,10,13,16H,8-9H2,1-3H3