N-[4-[3-(butan-2-ylamino)propoxy]phenyl]-4-oxidanylidene-1,5,6,7-tetrahydroindole-3-carboxamide

Systemtic Name: N-[4-[3-(butan-2-ylamino)propoxy]phenyl]-4-oxidanylidene-1,5,6,7-tetrahydroindole-3-carboxamide Openeye Name: 4-oxo-N-[4-[3-(sec-butylamino)propoxy]phenyl]-1,5,6,7-tetrahydroindole-3-carboxamide CAS Name: N-[4-[3-(butan-2-ylamino)propoxy]phenyl]-4-oxo-1,5,6,7-tetrahydroindole-3-carboxamide IUPAC Name: N-[4-[3-(butan-2-ylamino)propoxy]phenyl]-4-oxo-1,5,6,7-tetrahydroindole-3-carboxamide Traditional Name: 4-keto-N-[4-[3-(sec-butylamino)propoxy]phenyl]-1,5,6,7-tetrahydroindole-3-carboxamide Formula: C22H29N3O3 MolecularWeight: 383.48396

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NCCCOC1=CC=C(C=C1)NC(=O)C2=CNC3=C2C(=O)CCC3

Isomeric SMILES

CCC(C)NCCCOC1=CC=C(C=C1)NC(=O)C2=CNC3=C2C(=O)CCC3

InChI

InChI=1S/C22H29N3O3/c1-3-15(2)23-12-5-13-28-17-10-8-16(9-11-17)25-22(27)18-14-24-19-6-4-7-20(26)21(18)19/h8-11,14-15,23-24H,3-7,12-13H2,1-2H3,(H,25,27)