methyl 3-[(3-bromanyl-4-methoxy-phenyl)carbonylamino]-4-(4-methylpiperazin-1-yl)benzoate

Systemtic Name: methyl 3-[(3-bromanyl-4-methoxy-phenyl)carbonylamino]-4-(4-methylpiperazin-1-yl)benzoate Openeye Name: methyl 3-[(3-bromo-4-methoxy-benzoyl)amino]-4-(4-methylpiperazin-1-yl)benzoate CAS Name: 3-[[(3-bromo-4-methoxyphenyl)-oxomethyl]amino]-4-(4-methyl-1-piperazinyl)benzoic acid methyl ester IUPAC Name: methyl 3-[(3-bromo-4-methoxybenzoyl)amino]-4-(4-methylpiperazin-1-yl)benzoate Traditional Name: 3-[(3-bromo-4-methoxy-benzoyl)amino]-4-(4-methylpiperazino)benzoic acid methyl ester Formula: C21H24BrN3O4 MolecularWeight: 462.33696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)NC(=O)C3=CC(=C(C=C3)OC)Br

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)NC(=O)C3=CC(=C(C=C3)OC)Br

InChI

InChI=1S/C21H24BrN3O4/c1-24-8-10-25(11-9-24)18-6-4-15(21(27)29-3)13-17(18)23-20(26)14-5-7-19(28-2)16(22)12-14/h4-7,12-13H,8-11H2,1-3H3,(H,23,26)