methyl 4-methyl-3-[2-(4-methylpiperazin-1-yl)ethanoylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[2-(4-methylpiperazin-1-yl)ethanoylamino]benzoate Openeye Name: methyl 4-methyl-3-[[2-(4-methylpiperazin-1-yl)acetyl]amino]benzoate CAS Name: 4-methyl-3-[[2-(4-methyl-1-piperazinyl)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[2-(4-methylpiperazin-1-yl)acetyl]amino]benzoate Traditional Name: 4-methyl-3-[[2-(4-methylpiperazino)acetyl]amino]benzoic acid methyl ester Formula: C16H23N3O3 MolecularWeight: 305.37212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CN2CCN(CC2)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CN2CCN(CC2)C

InChI

InChI=1S/C16H23N3O3/c1-12-4-5-13(16(21)22-3)10-14(12)17-15(20)11-19-8-6-18(2)7-9-19/h4-5,10H,6-9,11H2,1-3H3,(H,17,20)