2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-[(3-methylphenyl)methyl]pyrrolidine

Systemtic Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-[(3-methylphenyl)methyl]pyrrolidine Openeye Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-(m-tolylmethyl)pyrrolidine CAS Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-[(3-methylphenyl)methyl]pyrrolidine IUPAC Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-[(3-methylphenyl)methyl]pyrrolidine Traditional Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-(3-methylbenzyl)pyrrolidine Formula: C21H25NO2 MolecularWeight: 323.4287

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCCC2C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCCC2C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C21H25NO2/c1-16-5-2-6-17(13-16)15-22-10-3-7-19(22)18-8-9-20-21(14-18)24-12-4-11-23-20/h2,5-6,8-9,13-14,19H,3-4,7,10-12,15H2,1H3