N-[2-(3-azanylphenoxy)ethyl]-4-oxidanylidene-1H-pyrimido[4,5-b]quinoline-2-carboxamide

Systemtic Name: N-[2-(3-azanylphenoxy)ethyl]-4-oxidanylidene-1H-pyrimido[4,5-b]quinoline-2-carboxamide Openeye Name: N-[2-(3-aminophenoxy)ethyl]-4-oxo-1H-pyrimido[4,5-b]quinoline-2-carboxamide CAS Name: N-[2-(3-aminophenoxy)ethyl]-4-oxo-1H-pyrimido[4,5-b]quinoline-2-carboxamide IUPAC Name: N-[2-(3-aminophenoxy)ethyl]-4-oxo-1H-pyrimido[4,5-b]quinoline-2-carboxamide Traditional Name: N-[2-(3-aminophenoxy)ethyl]-4-keto-1H-pyrimido[4,5-b]quinoline-2-carboxamide Formula: C20H17N5O3 MolecularWeight: 375.38068

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C3C(=N2)NC(=NC3=O)C(=O)NCCOC4=CC=CC(=C4)N

Isomeric SMILES

C1=CC=C2C(=C1)C=C3C(=N2)NC(=NC3=O)C(=O)NCCOC4=CC=CC(=C4)N

InChI

InChI=1S/C20H17N5O3/c21-13-5-3-6-14(11-13)28-9-8-22-20(27)18-24-17-15(19(26)25-18)10-12-4-1-2-7-16(12)23-17/h1-7,10-11H,8-9,21H2,(H,22,27)(H,23,24,25,26)