1-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-3,3-diphenyl-propan-1-one

Systemtic Name: 1-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-3,3-diphenyl-propan-1-one Openeye Name: 1-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-3,3-diphenyl-propan-1-one CAS Name: 1-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]-3,3-diphenyl-1-propanone IUPAC Name: 1-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-3,3-diphenylpropan-1-one Traditional Name: 1-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidino]-3,3-diphenyl-propan-1-one Formula: C28H29NO3 MolecularWeight: 427.53476

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CC(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC5=C(C=C4)OCCCO5

Isomeric SMILES

C1CC(N(C1)C(=O)CC(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC5=C(C=C4)OCCCO5

InChI

InChI=1S/C28H29NO3/c30-28(20-24(21-9-3-1-4-10-21)22-11-5-2-6-12-22)29-16-7-13-25(29)23-14-15-26-27(19-23)32-18-8-17-31-26/h1-6,9-12,14-15,19,24-25H,7-8,13,16-18,20H2