N-butyl-4-(2-methyl-6-prop-2-enyl-phenoxy)butan-1-amine; ethanedioic acid

Systemtic Name: N-butyl-4-(2-methyl-6-prop-2-enyl-phenoxy)butan-1-amine; ethanedioic acid Openeye Name: 4-(2-allyl-6-methyl-phenoxy)-N-butyl-butan-1-amine; oxalic acid CAS Name: N-butyl-4-(2-methyl-6-prop-2-enylphenoxy)-1-butanamine; oxalic acid IUPAC Name: N-butyl-4-(2-methyl-6-prop-2-enylphenoxy)butan-1-amine; oxalic acid Traditional Name: 4-(2-allyl-6-methyl-phenoxy)butyl-butyl-amine; oxalic acid Formula: C20H31NO5 MolecularWeight: 365.46384

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCCCCOC1=C(C=CC=C1CC=C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCNCCCCOC1=C(C=CC=C1CC=C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H29NO.C2H2O4/c1-4-6-13-19-14-7-8-15-20-18-16(3)11-9-12-17(18)10-5-2;3-1(4)2(5)6/h5,9,11-12,19H,2,4,6-8,10,13-15H2,1,3H3;(H,3,4)(H,5,6)