methyl 3-bromanyl-5-methyl-2-[3-(3-methylphenoxy)propylamino]benzoate

Systemtic Name: methyl 3-bromanyl-5-methyl-2-[3-(3-methylphenoxy)propylamino]benzoate Openeye Name: methyl 3-bromo-5-methyl-2-[3-(3-methylphenoxy)propylamino]benzoate CAS Name: 3-bromo-5-methyl-2-[3-(3-methylphenoxy)propylamino]benzoic acid methyl ester IUPAC Name: methyl 3-bromo-5-methyl-2-[3-(3-methylphenoxy)propylamino]benzoate Traditional Name: 3-bromo-5-methyl-2-[3-(3-methylphenoxy)propylamino]benzoic acid methyl ester Formula: C19H22BrNO3 MolecularWeight: 392.28688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCNC2=C(C=C(C=C2C(=O)OC)C)Br

Isomeric SMILES

CC1=CC(=CC=C1)OCCCNC2=C(C=C(C=C2C(=O)OC)C)Br

InChI

InChI=1S/C19H22BrNO3/c1-13-6-4-7-15(10-13)24-9-5-8-21-18-16(19(22)23-3)11-14(2)12-17(18)20/h4,6-7,10-12,21H,5,8-9H2,1-3H3