1-[(4-azanylquinazolin-7-yl)methyl]indole-2-carboxylic acid

Systemtic Name: 1-[(4-azanylquinazolin-7-yl)methyl]indole-2-carboxylic acid Openeye Name: 1-[(4-aminoquinazolin-7-yl)methyl]indole-2-carboxylic acid CAS Name: 1-[(4-amino-7-quinazolinyl)methyl]-2-indolecarboxylic acid IUPAC Name: 1-[(4-aminoquinazolin-7-yl)methyl]indole-2-carboxylic acid Traditional Name: 1-[(4-aminoquinazolin-7-yl)methyl]indole-2-carboxylic acid Formula: C18H14N4O2 MolecularWeight: 318.32936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(N2CC3=CC4=C(C=C3)C(=NC=N4)N)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(N2CC3=CC4=C(C=C3)C(=NC=N4)N)C(=O)O

InChI

InChI=1S/C18H14N4O2/c19-17-13-6-5-11(7-14(13)20-10-21-17)9-22-15-4-2-1-3-12(15)8-16(22)18(23)24/h1-8,10H,9H2,(H,23,24)(H2,19,20,21)