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

Systemtic Name: 4-[4-[(4-phenoxyphenyl)carbamoyl]piperazin-1-yl]quinazoline-7-carboxylic acid Openeye Name: 4-[4-[(4-phenoxyphenyl)carbamoyl]piperazin-1-yl]quinazoline-7-carboxylic acid CAS Name: 4-[4-[oxo-(4-phenoxyanilino)methyl]-1-piperazinyl]-7-quinazolinecarboxylic acid IUPAC Name: 4-[4-[(4-phenoxyphenyl)carbamoyl]piperazin-1-yl]quinazoline-7-carboxylic acid Traditional Name: 4-[4-[(4-phenoxyphenyl)carbamoyl]piperazino]quinazoline-7-carboxylic acid Formula: C26H23N5O4 MolecularWeight: 469.49192

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=NC3=C2C=CC(=C3)C(=O)O)C(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=NC=NC3=C2C=CC(=C3)C(=O)O)C(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C26H23N5O4/c32-25(33)18-6-11-22-23(16-18)27-17-28-24(22)30-12-14-31(15-13-30)26(34)29-19-7-9-21(10-8-19)35-20-4-2-1-3-5-20/h1-11,16-17H,12-15H2,(H,29,34)(H,32,33)