N-[(4-aminocarbonylphenyl)methyl]-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methyl-quinoline-4-carboxamide

Systemtic Name: N-[(4-aminocarbonylphenyl)methyl]-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methyl-quinoline-4-carboxamide Openeye Name: N-[(4-carbamoylphenyl)methyl]-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methyl-quinoline-4-carboxamide CAS Name: N-[(4-carbamoylphenyl)methyl]-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methyl-4-quinolinecarboxamide IUPAC Name: N-[(4-carbamoylphenyl)methyl]-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methylquinoline-4-carboxamide Traditional Name: N-(4-carbamoylbenzyl)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methyl-cinchoninamide Formula: C27H23N3O4 MolecularWeight: 453.48922

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)C(=O)N)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

CN(CC1=CC=C(C=C1)C(=O)N)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C27H23N3O4/c1-30(16-17-6-8-18(9-7-17)26(28)31)27(32)21-15-23(29-22-5-3-2-4-20(21)22)19-10-11-24-25(14-19)34-13-12-33-24/h2-11,14-15H,12-13,16H2,1H3,(H2,28,31)