2,2-dimethyl-6-[(phenylmethyl)amino]-1,3-dioxepan-5-ol

Systemtic Name: 2,2-dimethyl-6-[(phenylmethyl)amino]-1,3-dioxepan-5-ol Openeye Name: 6-(benzylamino)-2,2-dimethyl-1,3-dioxepan-5-ol CAS Name: 2,2-dimethyl-6-[(phenylmethyl)amino]-1,3-dioxepan-5-ol IUPAC Name: 6-(benzylamino)-2,2-dimethyl-1,3-dioxepan-5-ol Traditional Name: 6-(benzylamino)-2,2-dimethyl-1,3-dioxepan-5-ol Formula: C14H21NO3 MolecularWeight: 251.32144

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(C(CO1)O)NCC2=CC=CC=C2)C

Isomeric SMILES

CC1(OCC(C(CO1)O)NCC2=CC=CC=C2)C

InChI

InChI=1S/C14H21NO3/c1-14(2)17-9-12(13(16)10-18-14)15-8-11-6-4-3-5-7-11/h3-7,12-13,15-16H,8-10H2,1-2H3