N-[4-[(3-bromophenyl)amino]-3-cyano-7-methoxy-quinolin-6-yl]prop-2-ynamide

Systemtic Name: N-[4-[(3-bromophenyl)amino]-3-cyano-7-methoxy-quinolin-6-yl]prop-2-ynamide Openeye Name: N-[4-(3-bromoanilino)-3-cyano-7-methoxy-6-quinolyl]prop-2-ynamide CAS Name: N-[4-(3-bromoanilino)-3-cyano-7-methoxy-6-quinolinyl]-2-propynamide IUPAC Name: N-[4-(3-bromoanilino)-3-cyano-7-methoxyquinolin-6-yl]prop-2-ynamide Traditional Name: N-[4-(3-bromoanilino)-3-cyano-7-methoxy-6-quinolyl]propiolamide Formula: C20H13BrN4O2 MolecularWeight: 421.24682

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=CC(=C2NC3=CC(=CC=C3)Br)C#N)NC(=O)C#C

Isomeric SMILES

COC1=C(C=C2C(=C1)N=CC(=C2NC3=CC(=CC=C3)Br)C#N)NC(=O)C#C

InChI

InChI=1S/C20H13BrN4O2/c1-3-19(26)25-17-8-15-16(9-18(17)27-2)23-11-12(10-22)20(15)24-14-6-4-5-13(21)7-14/h1,4-9,11H,2H3,(H,23,24)(H,25,26)