6-chloranyl-N-[2-(1H-indol-3-yl)ethyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide

Systemtic Name: 6-chloranyl-N-[2-(1H-indol-3-yl)ethyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Openeye Name: 6-chloro-N-[2-(1H-indol-3-yl)ethyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide CAS Name: 6-chloro-N-[2-(1H-indol-3-yl)ethyl]-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide IUPAC Name: 6-chloro-N-[2-(1H-indol-3-yl)ethyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Traditional Name: 6-chloro-N-[2-(1H-indol-3-yl)ethyl]-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide Formula: C20H19ClN2O3 MolecularWeight: 370.82946

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)C(=O)NCCC3=CNC4=CC=CC=C43)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)C(=O)NCCC3=CNC4=CC=CC=C43)Cl)OC1

InChI

InChI=1S/C20H19ClN2O3/c21-16-10-14(11-18-19(16)26-9-3-8-25-18)20(24)22-7-6-13-12-23-17-5-2-1-4-15(13)17/h1-2,4-5,10-12,23H,3,6-9H2,(H,22,24)