methyl 2-[(3-bromanyl-4-methoxy-phenyl)methylamino]-4-methyl-pentanoate

Systemtic Name: methyl 2-[(3-bromanyl-4-methoxy-phenyl)methylamino]-4-methyl-pentanoate Openeye Name: methyl 2-[(3-bromo-4-methoxy-phenyl)methylamino]-4-methyl-pentanoate CAS Name: 2-[(3-bromo-4-methoxyphenyl)methylamino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[(3-bromo-4-methoxyphenyl)methylamino]-4-methylpentanoate Traditional Name: 2-[(3-bromo-4-methoxy-benzyl)amino]-4-methyl-valeric acid methyl ester Formula: C15H22BrNO3 MolecularWeight: 344.24408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22BrNO3/c1-10(2)7-13(15(18)20-4)17-9-11-5-6-14(19-3)12(16)8-11/h5-6,8,10,13,17H,7,9H2,1-4H3