N-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbonylamino)ethyl]-1-methyl-indole-2-carboxamide

Systemtic Name: N-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbonylamino)ethyl]-1-methyl-indole-2-carboxamide Openeye Name: N-[2-(3,4-dihydro-2H-1,5-benzodioxepine-7-carbonylamino)ethyl]-1-methyl-indole-2-carboxamide CAS Name: N-[2-[[3,4-dihydro-2H-1,5-benzodioxepin-7-yl(oxo)methyl]amino]ethyl]-1-methyl-2-indolecarboxamide IUPAC Name: N-[2-(3,4-dihydro-2H-1,5-benzodioxepine-7-carbonylamino)ethyl]-1-methylindole-2-carboxamide Traditional Name: N-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-carbonylamino)ethyl]-1-methyl-indole-2-carboxamide Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C=C1C(=O)NCCNC(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CN1C2=CC=CC=C2C=C1C(=O)NCCNC(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C22H23N3O4/c1-25-17-6-3-2-5-15(17)13-18(25)22(27)24-10-9-23-21(26)16-7-8-19-20(14-16)29-12-4-11-28-19/h2-3,5-8,13-14H,4,9-12H2,1H3,(H,23,26)(H,24,27)