N-[2-(6-methoxy-1H-indol-3-yl)ethyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide

Systemtic Name: N-[2-(6-methoxy-1H-indol-3-yl)ethyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Openeye Name: N-[2-(6-methoxy-1H-indol-3-yl)ethyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide CAS Name: N-[2-(6-methoxy-1H-indol-3-yl)ethyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide IUPAC Name: N-[2-(6-methoxy-1H-indol-3-yl)ethyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Traditional Name: N-[2-(6-methoxy-1H-indol-3-yl)ethyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CN2)CCNC(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CN2)CCNC(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C21H22N2O4/c1-25-16-4-5-17-15(13-23-18(17)12-16)7-8-22-21(24)14-3-6-19-20(11-14)27-10-2-9-26-19/h3-6,11-13,23H,2,7-10H2,1H3,(H,22,24)