ethanedioic acid; 8-[3-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]propoxy]-2-methyl-quinoline

Systemtic Name: ethanedioic acid; 8-[3-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]propoxy]-2-methyl-quinoline Openeye Name: 8-[3-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]propoxy]-2-methyl-quinoline; oxalic acid CAS Name: 8-[3-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]propoxy]-2-methylquinoline; oxalic acid IUPAC Name: 8-[3-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]propoxy]-2-methylquinoline; oxalic acid Traditional Name: 8-[3-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]propoxy]-2-methyl-quinoline; oxalic acid Formula: C25H27NO7 MolecularWeight: 453.48438

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC1=CC(=C(C=C1)OCCCOC2=CC=CC3=C2N=C(C=C3)C)OC.C(=O)(C(=O)O)O

Isomeric SMILES

C/C=C/C1=CC(=C(C=C1)OCCCOC2=CC=CC3=C2N=C(C=C3)C)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C23H25NO3.C2H2O4/c1-4-7-18-11-13-20(22(16-18)25-3)26-14-6-15-27-21-9-5-8-19-12-10-17(2)24-23(19)21;3-1(4)2(5)6/h4-5,7-13,16H,6,14-15H2,1-3H3;(H,3,4)(H,5,6)/b7-4+;