2-azanyl-4-[5-[3-(4-chloranylphenoxy)prop-1-ynyl]furan-2-yl]-2-methyl-butan-1-ol; ethanedioic acid

Systemtic Name: 2-azanyl-4-[5-[3-(4-chloranylphenoxy)prop-1-ynyl]furan-2-yl]-2-methyl-butan-1-ol; ethanedioic acid Openeye Name: 2-amino-4-[5-[3-(4-chlorophenoxy)prop-1-ynyl]-2-furyl]-2-methyl-butan-1-ol; oxalic acid CAS Name: 2-amino-4-[5-[3-(4-chlorophenoxy)prop-1-ynyl]-2-furanyl]-2-methyl-1-butanol; oxalic acid IUPAC Name: 2-amino-4-[5-[3-(4-chlorophenoxy)prop-1-ynyl]furan-2-yl]-2-methylbutan-1-ol; oxalic acid Traditional Name: 2-amino-4-[5-[3-(4-chlorophenoxy)prop-1-ynyl]-2-furyl]-2-methyl-butan-1-ol; oxalic acid Formula: C20H22ClNO7 MolecularWeight: 423.84418

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(O1)C#CCOC2=CC=C(C=C2)Cl)(CO)N.C(=O)(C(=O)O)O

Isomeric SMILES

CC(CCC1=CC=C(O1)C#CCOC2=CC=C(C=C2)Cl)(CO)N.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H20ClNO3.C2H2O4/c1-18(20,13-21)11-10-17-9-8-16(23-17)3-2-12-22-15-6-4-14(19)5-7-15;3-1(4)2(5)6/h4-9,21H,10-13,20H2,1H3;(H,3,4)(H,5,6)