ethanedioic acid; 1-[[2-(furan-2-yl)-2-pyrrolidin-1-yl-ethyl]amino]-3-phenoxy-propan-2-ol

Systemtic Name: ethanedioic acid; 1-[[2-(furan-2-yl)-2-pyrrolidin-1-yl-ethyl]amino]-3-phenoxy-propan-2-ol Openeye Name: 1-[[2-(2-furyl)-2-pyrrolidin-1-yl-ethyl]amino]-3-phenoxy-propan-2-ol; oxalic acid CAS Name: 1-[[2-(2-furanyl)-2-(1-pyrrolidinyl)ethyl]amino]-3-phenoxy-2-propanol; oxalic acid IUPAC Name: 1-[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]-3-phenoxypropan-2-ol; oxalic acid Traditional Name: 1-[[2-(2-furyl)-2-pyrrolidino-ethyl]amino]-3-phenoxy-propan-2-ol; oxalic acid Formula: C21H28N2O7 MolecularWeight: 420.45622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNCC(COC2=CC=CC=C2)O)C3=CC=CO3.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCN(C1)C(CNCC(COC2=CC=CC=C2)O)C3=CC=CO3.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H26N2O3.C2H2O4/c22-16(15-24-17-7-2-1-3-8-17)13-20-14-18(19-9-6-12-23-19)21-10-4-5-11-21;3-1(4)2(5)6/h1-3,6-9,12,16,18,20,22H,4-5,10-11,13-15H2;(H,3,4)(H,5,6)