4-[4-(phenylmethyl)piperazin-1-yl]quinazoline-7-carboxylic acid

Systemtic Name: 4-[4-(phenylmethyl)piperazin-1-yl]quinazoline-7-carboxylic acid Openeye Name: 4-(4-benzylpiperazin-1-yl)quinazoline-7-carboxylic acid CAS Name: 4-[4-(phenylmethyl)-1-piperazinyl]-7-quinazolinecarboxylic acid IUPAC Name: 4-(4-benzylpiperazin-1-yl)quinazoline-7-carboxylic acid Traditional Name: 4-(4-benzylpiperazino)quinazoline-7-carboxylic acid Formula: C20H20N4O2 MolecularWeight: 348.3984

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=NC=NC4=C3C=CC(=C4)C(=O)O

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=NC=NC4=C3C=CC(=C4)C(=O)O

InChI

InChI=1S/C20H20N4O2/c25-20(26)16-6-7-17-18(12-16)21-14-22-19(17)24-10-8-23(9-11-24)13-15-4-2-1-3-5-15/h1-7,12,14H,8-11,13H2,(H,25,26)