ethanedioic acid; 1-[2-(5-methyl-2-propan-2-yl-phenoxy)ethyl]-3,4-dihydro-2H-quinoline

Systemtic Name: ethanedioic acid; 1-[2-(5-methyl-2-propan-2-yl-phenoxy)ethyl]-3,4-dihydro-2H-quinoline Openeye Name: 1-[2-(2-isopropyl-5-methyl-phenoxy)ethyl]-3,4-dihydro-2H-quinoline; oxalic acid CAS Name: 1-[2-(5-methyl-2-propan-2-ylphenoxy)ethyl]-3,4-dihydro-2H-quinoline; oxalic acid IUPAC Name: 1-[2-(5-methyl-2-propan-2-ylphenoxy)ethyl]-3,4-dihydro-2H-quinoline; oxalic acid Traditional Name: 1-[2-(2-isopropyl-5-methyl-phenoxy)ethyl]-3,4-dihydro-2H-quinoline; oxalic acid Formula: C23H29NO5 MolecularWeight: 399.48006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCCN2CCCC3=CC=CC=C32.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCCN2CCCC3=CC=CC=C32.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H27NO.C2H2O4/c1-16(2)19-11-10-17(3)15-21(19)23-14-13-22-12-6-8-18-7-4-5-9-20(18)22;3-1(4)2(5)6/h4-5,7,9-11,15-16H,6,8,12-14H2,1-3H3;(H,3,4)(H,5,6)