4-[(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)methyl]phenol

Systemtic Name: 4-[(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)methyl]phenol Openeye Name: 4-[(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)methyl]phenol CAS Name: 4-[(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)methyl]phenol IUPAC Name: 4-[(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)methyl]phenol Traditional Name: 4-[(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)methyl]phenol Formula: C16H17NO3 MolecularWeight: 271.31108

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NCC3=CC=C(C=C3)O)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NCC3=CC=C(C=C3)O)OC1

InChI

InChI=1S/C16H17NO3/c18-14-5-2-12(3-6-14)11-17-13-4-7-15-16(10-13)20-9-1-8-19-15/h2-7,10,17-18H,1,8-9,11H2