N-(3-pyrrol-1-ylphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-6-carboxamide

Systemtic Name: N-(3-pyrrol-1-ylphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-6-carboxamide Openeye Name: N-(3-pyrrol-1-ylphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-6-carboxamide CAS Name: N-[3-(1-pyrrolyl)phenyl]-3,4-dihydro-2H-1,5-benzodioxepin-6-carboxamide IUPAC Name: N-(3-pyrrol-1-ylphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-6-carboxamide Traditional Name: N-(3-pyrrol-1-ylphenyl)-3,4-dihydro-2H-1,5-benzodioxepin-6-carboxamide Formula: C20H18N2O3 MolecularWeight: 334.36852

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC(=C2OC1)C(=O)NC3=CC=CC(=C3)N4C=CC=C4

Isomeric SMILES

C1COC2=CC=CC(=C2OC1)C(=O)NC3=CC=CC(=C3)N4C=CC=C4

InChI

InChI=1S/C20H18N2O3/c23-20(17-8-4-9-18-19(17)25-13-5-12-24-18)21-15-6-3-7-16(14-15)22-10-1-2-11-22/h1-4,6-11,14H,5,12-13H2,(H,21,23)