N-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]-2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxamide

Systemtic Name: N-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]-2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxamide Openeye Name: N-[2-(benzylamino)-2-oxo-ethyl]-2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxamide CAS Name: N-[2-oxo-2-[(phenylmethyl)amino]ethyl]-2-(3,4,5-trimethoxyphenyl)-4-quinolinecarboxamide IUPAC Name: N-[2-(benzylamino)-2-oxoethyl]-2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxamide Traditional Name: N-[2-(benzylamino)-2-keto-ethyl]-2-(3,4,5-trimethoxyphenyl)cinchoninamide Formula: C28H27N3O5 MolecularWeight: 485.53108

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC(=O)NCC4=CC=CC=C4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C28H27N3O5/c1-34-24-13-19(14-25(35-2)27(24)36-3)23-15-21(20-11-7-8-12-22(20)31-23)28(33)30-17-26(32)29-16-18-9-5-4-6-10-18/h4-15H,16-17H2,1-3H3,(H,29,32)(H,30,33)