5-[4-(1H-indol-5-ylamino)-7-methoxy-quinazolin-6-yl]pyridine-3-carboxylic acid

Systemtic Name: 5-[4-(1H-indol-5-ylamino)-7-methoxy-quinazolin-6-yl]pyridine-3-carboxylic acid Openeye Name: 5-[4-(1H-indol-5-ylamino)-7-methoxy-quinazolin-6-yl]pyridine-3-carboxylic acid CAS Name: 5-[4-(1H-indol-5-ylamino)-7-methoxy-6-quinazolinyl]-3-pyridinecarboxylic acid IUPAC Name: 5-[4-(1H-indol-5-ylamino)-7-methoxyquinazolin-6-yl]pyridine-3-carboxylic acid Traditional Name: 5-[4-(1H-indol-5-ylamino)-7-methoxy-quinazolin-6-yl]nicotinic acid Formula: C23H17N5O3 MolecularWeight: 411.41278

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=CN=C2NC3=CC4=C(C=C3)NC=C4)C5=CC(=CN=C5)C(=O)O

Isomeric SMILES

COC1=C(C=C2C(=C1)N=CN=C2NC3=CC4=C(C=C3)NC=C4)C5=CC(=CN=C5)C(=O)O

InChI

InChI=1S/C23H17N5O3/c1-31-21-9-20-18(8-17(21)14-6-15(23(29)30)11-24-10-14)22(27-12-26-20)28-16-2-3-19-13(7-16)4-5-25-19/h2-12,25H,1H3,(H,29,30)(H,26,27,28)