N-[4-[(3,4-diethoxyphenyl)methoxy]phenyl]-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide

Systemtic Name: N-[4-[(3,4-diethoxyphenyl)methoxy]phenyl]-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide Openeye Name: N-[4-[(3,4-diethoxyphenyl)methoxy]phenyl]-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide CAS Name: N-[4-[(3,4-diethoxyphenyl)methoxy]phenyl]-2-(1-methyl-4-pyrazolyl)-4-quinolinecarboxamide IUPAC Name: N-[4-[(3,4-diethoxyphenyl)methoxy]phenyl]-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide Traditional Name: N-[4-(3,4-diethoxybenzyl)oxyphenyl]-2-(1-methylpyrazol-4-yl)cinchoninamide Formula: C31H30N4O4 MolecularWeight: 522.5943

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)COC2=CC=C(C=C2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CN(N=C5)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)COC2=CC=C(C=C2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CN(N=C5)C)OCC

InChI

InChI=1S/C31H30N4O4/c1-4-37-29-15-10-21(16-30(29)38-5-2)20-39-24-13-11-23(12-14-24)33-31(36)26-17-28(22-18-32-35(3)19-22)34-27-9-7-6-8-25(26)27/h6-19H,4-5,20H2,1-3H3,(H,33,36)