ethanedioic acid; 3-methoxy-4-(2-pyrrolidin-1-ylethoxy)benzaldehyde

Systemtic Name: ethanedioic acid; 3-methoxy-4-(2-pyrrolidin-1-ylethoxy)benzaldehyde Openeye Name: 3-methoxy-4-(2-pyrrolidin-1-ylethoxy)benzaldehyde; oxalic acid CAS Name: 3-methoxy-4-[2-(1-pyrrolidinyl)ethoxy]benzaldehyde; oxalic acid IUPAC Name: 3-methoxy-4-(2-pyrrolidin-1-ylethoxy)benzaldehyde; oxalic acid Traditional Name: 3-methoxy-4-(2-pyrrolidinoethoxy)benzaldehyde; oxalic acid Formula: C16H21NO7 MolecularWeight: 339.34044

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=O)OCCN2CCCC2.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=C(C=CC(=C1)C=O)OCCN2CCCC2.C(=O)(C(=O)O)O

InChI

InChI=1S/C14H19NO3.C2H2O4/c1-17-14-10-12(11-16)4-5-13(14)18-9-8-15-6-2-3-7-15;3-1(4)2(5)6/h4-5,10-11H,2-3,6-9H2,1H3;(H,3,4)(H,5,6)