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

Systemtic Name: N-[4-[(3-bromophenyl)amino]-3-cyano-quinolin-6-yl]-3-(2-methoxyethoxy)prop-2-ynamide Openeye Name: N-[4-(3-bromoanilino)-3-cyano-6-quinolyl]-3-(2-methoxyethoxy)prop-2-ynamide CAS Name: N-[4-(3-bromoanilino)-3-cyano-6-quinolinyl]-3-(2-methoxyethoxy)-2-propynamide IUPAC Name: N-[4-(3-bromoanilino)-3-cyanoquinolin-6-yl]-3-(2-methoxyethoxy)prop-2-ynamide Traditional Name: N-[4-(3-bromoanilino)-3-cyano-6-quinolyl]-3-(2-methoxyethoxy)propiolamide Formula: C22H17BrN4O3 MolecularWeight: 465.29938

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC#CC(=O)NC1=CC2=C(C(=CN=C2C=C1)C#N)NC3=CC(=CC=C3)Br

Isomeric SMILES

COCCOC#CC(=O)NC1=CC2=C(C(=CN=C2C=C1)C#N)NC3=CC(=CC=C3)Br

InChI

InChI=1S/C22H17BrN4O3/c1-29-9-10-30-8-7-21(28)26-18-5-6-20-19(12-18)22(15(13-24)14-25-20)27-17-4-2-3-16(23)11-17/h2-6,11-12,14H,9-10H2,1H3,(H,25,27)(H,26,28)