methyl 2-[[3,5-bis(bromanyl)-4-methoxy-phenyl]methylamino]-4-methyl-pentanoate

Systemtic Name: methyl 2-[[3,5-bis(bromanyl)-4-methoxy-phenyl]methylamino]-4-methyl-pentanoate Openeye Name: methyl 2-[(3,5-dibromo-4-methoxy-phenyl)methylamino]-4-methyl-pentanoate CAS Name: 2-[(3,5-dibromo-4-methoxyphenyl)methylamino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[(3,5-dibromo-4-methoxyphenyl)methylamino]-4-methylpentanoate Traditional Name: 2-[(3,5-dibromo-4-methoxy-benzyl)amino]-4-methyl-valeric acid methyl ester Formula: C15H21Br2NO3 MolecularWeight: 423.14014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21Br2NO3/c1-9(2)5-13(15(19)21-4)18-8-10-6-11(16)14(20-3)12(17)7-10/h6-7,9,13,18H,5,8H2,1-4H3