3-[2-[1-(phenylmethyl)piperidin-4-yl]ethyl]-6-pyrrolidin-1-yl-1,2-benzoxazole

Systemtic Name: 3-[2-[1-(phenylmethyl)piperidin-4-yl]ethyl]-6-pyrrolidin-1-yl-1,2-benzoxazole Openeye Name: 3-[2-(1-benzyl-4-piperidyl)ethyl]-6-pyrrolidin-1-yl-1,2-benzoxazole CAS Name: 3-[2-[1-(phenylmethyl)-4-piperidinyl]ethyl]-6-(1-pyrrolidinyl)-1,2-benzoxazole IUPAC Name: 3-[2-(1-benzylpiperidin-4-yl)ethyl]-6-pyrrolidin-1-yl-1,2-benzoxazole Traditional Name: 3-[2-(1-benzyl-4-piperidyl)ethyl]-6-pyrrolidino-indoxazene Formula: C25H31N3O MolecularWeight: 389.53314

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC3=C(C=C2)C(=NO3)CCC4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)C2=CC3=C(C=C2)C(=NO3)CCC4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C25H31N3O/c1-2-6-21(7-3-1)19-27-16-12-20(13-17-27)8-11-24-23-10-9-22(18-25(23)29-26-24)28-14-4-5-15-28/h1-3,6-7,9-10,18,20H,4-5,8,11-17,19H2