2-[5-[(3-bromophenyl)amino]pyrazolo[4,3-g]quinazolin-1-yl]ethanoic acid

Systemtic Name: 2-[5-[(3-bromophenyl)amino]pyrazolo[4,3-g]quinazolin-1-yl]ethanoic acid Openeye Name: 2-[5-(3-bromoanilino)pyrazolo[4,3-g]quinazolin-1-yl]acetic acid CAS Name: 2-[5-(3-bromoanilino)-1-pyrazolo[4,3-g]quinazolinyl]acetic acid IUPAC Name: 2-[5-(3-bromoanilino)pyrazolo[4,3-g]quinazolin-1-yl]acetic acid Traditional Name: 2-[5-(3-bromoanilino)pyrazolo[4,3-g]quinazolin-1-yl]acetic acid Formula: C17H12BrN5O2 MolecularWeight: 398.21348

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)NC2=NC=NC3=C2C=C4C=NN(C4=C3)CC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Br)NC2=NC=NC3=C2C=C4C=NN(C4=C3)CC(=O)O

InChI

InChI=1S/C17H12BrN5O2/c18-11-2-1-3-12(5-11)22-17-13-4-10-7-21-23(8-16(24)25)15(10)6-14(13)19-9-20-17/h1-7,9H,8H2,(H,24,25)(H,19,20,22)