2-oxidanyl-2,2-diphenyl-ethanoic acid; N-[6-(2-piperidin-1-ylethyl)-1,3-benzodioxol-5-yl]-1-pyridin-3-yl-methanimine

Systemtic Name: 2-oxidanyl-2,2-diphenyl-ethanoic acid; N-[6-(2-piperidin-1-ylethyl)-1,3-benzodioxol-5-yl]-1-pyridin-3-yl-methanimine Openeye Name: 2-hydroxy-2,2-diphenyl-acetic acid; N-[6-[2-(1-piperidyl)ethyl]-1,3-benzodioxol-5-yl]-1-(3-pyridyl)methanimine CAS Name: 2-hydroxy-2,2-diphenylacetic acid; N-[6-[2-(1-piperidinyl)ethyl]-1,3-benzodioxol-5-yl]-1-(3-pyridinyl)methanimine IUPAC Name: 2-hydroxy-2,2-diphenylacetic acid; N-[6-(2-piperidin-1-ylethyl)-1,3-benzodioxol-5-yl]-1-pyridin-3-ylmethanimine Traditional Name: benzilic acid; [6-(2-piperidinoethyl)-1,3-benzodioxol-5-yl]-(3-pyridylmethylene)amine Formula: C34H35N3O5 MolecularWeight: 565.6588

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCC2=CC3=C(C=C2N=CC4=CN=CC=C4)OCO3.C1=CC=C(C=C1)C(C2=CC=CC=C2)(C(=O)O)O

Isomeric SMILES

C1CCN(CC1)CCC2=CC3=C(C=C2N=CC4=CN=CC=C4)OCO3.C1=CC=C(C=C1)C(C2=CC=CC=C2)(C(=O)O)O

InChI

InChI=1S/C20H23N3O2.C14H12O3/c1-2-8-23(9-3-1)10-6-17-11-19-20(25-15-24-19)12-18(17)22-14-16-5-4-7-21-13-16;15-13(16)14(17,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h4-5,7,11-14H,1-3,6,8-10,15H2;1-10,17H,(H,15,16)