ethanedioic acid; 4-(3-methylphenoxy)-N-(phenylmethyl)butan-1-amine

Systemtic Name: ethanedioic acid; 4-(3-methylphenoxy)-N-(phenylmethyl)butan-1-amine Openeye Name: N-benzyl-4-(3-methylphenoxy)butan-1-amine; oxalic acid CAS Name: 4-(3-methylphenoxy)-N-(phenylmethyl)-1-butanamine; oxalic acid IUPAC Name: N-benzyl-4-(3-methylphenoxy)butan-1-amine; oxalic acid Traditional Name: benzyl-[4-(3-methylphenoxy)butyl]amine; oxalic acid Formula: C20H25NO5 MolecularWeight: 359.4162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCCNCC2=CC=CC=C2.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=CC=C1)OCCCCNCC2=CC=CC=C2.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H23NO.C2H2O4/c1-16-8-7-11-18(14-16)20-13-6-5-12-19-15-17-9-3-2-4-10-17;3-1(4)2(5)6/h2-4,7-11,14,19H,5-6,12-13,15H2,1H3;(H,3,4)(H,5,6)