4-[[4-(4-methylpiperazin-1-yl)phenyl]amino]quinazoline-5-carboxylic acid

Systemtic Name: 4-[[4-(4-methylpiperazin-1-yl)phenyl]amino]quinazoline-5-carboxylic acid Openeye Name: 4-[4-(4-methylpiperazin-1-yl)anilino]quinazoline-5-carboxylic acid CAS Name: 4-[4-(4-methyl-1-piperazinyl)anilino]-5-quinazolinecarboxylic acid IUPAC Name: 4-[4-(4-methylpiperazin-1-yl)anilino]quinazoline-5-carboxylic acid Traditional Name: 4-[4-(4-methylpiperazino)anilino]quinazoline-5-carboxylic acid Formula: C20H21N5O2 MolecularWeight: 363.41304

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=C(C=C2)NC3=NC=NC4=CC=CC(=C43)C(=O)O

Isomeric SMILES

CN1CCN(CC1)C2=CC=C(C=C2)NC3=NC=NC4=CC=CC(=C43)C(=O)O

InChI

InChI=1S/C20H21N5O2/c1-24-9-11-25(12-10-24)15-7-5-14(6-8-15)23-19-18-16(20(26)27)3-2-4-17(18)21-13-22-19/h2-8,13H,9-12H2,1H3,(H,26,27)(H,21,22,23)