2-cyclopropyl-N-[(E)-[3-(4-methylphenoxy)phenyl]methylideneamino]quinoline-4-carboxamide

Systemtic Name: 2-cyclopropyl-N-[(E)-[3-(4-methylphenoxy)phenyl]methylideneamino]quinoline-4-carboxamide Openeye Name: 2-cyclopropyl-N-[(E)-[3-(4-methylphenoxy)phenyl]methyleneamino]quinoline-4-carboxamide CAS Name: 2-cyclopropyl-N-[(E)-[3-(4-methylphenoxy)phenyl]methylideneamino]-4-quinolinecarboxamide IUPAC Name: 2-cyclopropyl-N-[(E)-[3-(4-methylphenoxy)phenyl]methylideneamino]quinoline-4-carboxamide Traditional Name: 2-cyclopropyl-N-[(E)-[3-(4-methylphenoxy)benzylidene]amino]cinchoninamide Formula: C27H23N3O2 MolecularWeight: 421.49042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=CC=CC(=C2)C=NNC(=O)C3=CC(=NC4=CC=CC=C43)C5CC5

Isomeric SMILES

CC1=CC=C(C=C1)OC2=CC=CC(=C2)/C=N/NC(=O)C3=CC(=NC4=CC=CC=C43)C5CC5

InChI

InChI=1S/C27H23N3O2/c1-18-9-13-21(14-10-18)32-22-6-4-5-19(15-22)17-28-30-27(31)24-16-26(20-11-12-20)29-25-8-3-2-7-23(24)25/h2-10,13-17,20H,11-12H2,1H3,(H,30,31)/b28-17+