4,5-dimethoxy-N-[4-oxidanylidene-4-(pyridin-2-ylamino)butyl]-1H-indole-2-carboxamide

Systemtic Name: 4,5-dimethoxy-N-[4-oxidanylidene-4-(pyridin-2-ylamino)butyl]-1H-indole-2-carboxamide Openeye Name: 4,5-dimethoxy-N-[4-oxo-4-(2-pyridylamino)butyl]-1H-indole-2-carboxamide CAS Name: 4,5-dimethoxy-N-[4-oxo-4-(2-pyridinylamino)butyl]-1H-indole-2-carboxamide IUPAC Name: 4,5-dimethoxy-N-[4-oxo-4-(pyridin-2-ylamino)butyl]-1H-indole-2-carboxamide Traditional Name: N-[4-keto-4-(2-pyridylamino)butyl]-4,5-dimethoxy-1H-indole-2-carboxamide Formula: C20H22N4O4 MolecularWeight: 382.41308

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)NC(=C2)C(=O)NCCCC(=O)NC3=CC=CC=N3)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)NC(=C2)C(=O)NCCCC(=O)NC3=CC=CC=N3)OC

InChI

InChI=1S/C20H22N4O4/c1-27-16-9-8-14-13(19(16)28-2)12-15(23-14)20(26)22-11-5-7-18(25)24-17-6-3-4-10-21-17/h3-4,6,8-10,12,23H,5,7,11H2,1-2H3,(H,22,26)(H,21,24,25)