N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide

Systemtic Name: N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Openeye Name: N-[(4S)-chroman-4-yl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide CAS Name: N-[(4S)-3,4-dihydro-2H-1-benzopyran-4-yl]-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide IUPAC Name: N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Traditional Name: N-[(4S)-chroman-4-yl]-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide Formula: C19H19NO4 MolecularWeight: 325.35846

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)C(=O)NC3CCOC4=CC=CC=C34)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)C(=O)N[C@H]3CCOC4=CC=CC=C34)OC1

InChI

InChI=1S/C19H19NO4/c21-19(13-6-7-17-18(12-13)23-10-3-9-22-17)20-15-8-11-24-16-5-2-1-4-14(15)16/h1-2,4-7,12,15H,3,8-11H2,(H,20,21)/t15-/m0/s1