N-[2-[[(3R)-1-(1,3-benzodioxol-5-ylmethyl)pyrrolidin-3-yl]amino]-2-oxidanylidene-ethyl]-5-tert-butyl-furan-2-carboxamide

Systemtic Name: N-[2-[[(3R)-1-(1,3-benzodioxol-5-ylmethyl)pyrrolidin-3-yl]amino]-2-oxidanylidene-ethyl]-5-tert-butyl-furan-2-carboxamide Openeye Name: N-[2-[[(3R)-1-(1,3-benzodioxol-5-ylmethyl)pyrrolidin-3-yl]amino]-2-oxo-ethyl]-5-tert-butyl-furan-2-carboxamide CAS Name: N-[2-[[(3R)-1-(1,3-benzodioxol-5-ylmethyl)-3-pyrrolidinyl]amino]-2-oxoethyl]-5-tert-butyl-2-furancarboxamide IUPAC Name: N-[2-[[(3R)-1-(1,3-benzodioxol-5-ylmethyl)pyrrolidin-3-yl]amino]-2-oxoethyl]-5-tert-butylfuran-2-carboxamide Traditional Name: 5-tert-butyl-N-[2-keto-2-[[(3R)-1-piperonylpyrrolidin-3-yl]amino]ethyl]-2-furamide Formula: C23H29N3O5 MolecularWeight: 427.49346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(O1)C(=O)NCC(=O)NC2CCN(C2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C)(C)C1=CC=C(O1)C(=O)NCC(=O)N[C@@H]2CCN(C2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H29N3O5/c1-23(2,3)20-7-6-18(31-20)22(28)24-11-21(27)25-16-8-9-26(13-16)12-15-4-5-17-19(10-15)30-14-29-17/h4-7,10,16H,8-9,11-14H2,1-3H3,(H,24,28)(H,25,27)/t16-/m1/s1