4-[1-[4-(2-methylphenyl)piperazin-1-yl]ethylcarbamoylamino]furan-3-carboxylic acid

Systemtic Name: 4-[1-[4-(2-methylphenyl)piperazin-1-yl]ethylcarbamoylamino]furan-3-carboxylic acid Openeye Name: 4-[1-[4-(o-tolyl)piperazin-1-yl]ethylcarbamoylamino]furan-3-carboxylic acid CAS Name: 4-[[[1-[4-(2-methylphenyl)-1-piperazinyl]ethylamino]-oxomethyl]amino]-3-furancarboxylic acid IUPAC Name: 4-[1-[4-(2-methylphenyl)piperazin-1-yl]ethylcarbamoylamino]furan-3-carboxylic acid Traditional Name: 4-[1-[4-(o-tolyl)piperazino]ethylcarbamoylamino]-3-furoic acid Formula: C19H24N4O4 MolecularWeight: 372.41826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)C(C)NC(=O)NC3=COC=C3C(=O)O

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)C(C)NC(=O)NC3=COC=C3C(=O)O

InChI

InChI=1S/C19H24N4O4/c1-13-5-3-4-6-17(13)23-9-7-22(8-10-23)14(2)20-19(26)21-16-12-27-11-15(16)18(24)25/h3-6,11-12,14H,7-10H2,1-2H3,(H,24,25)(H2,20,21,26)