2-oxidanylbutanedioic acid; (E)-N,6,6-trimethyl-N-(naphthalen-1-ylmethyl)hept-2-en-4-yn-1-amine

Systemtic Name: 2-oxidanylbutanedioic acid; (E)-N,6,6-trimethyl-N-(naphthalen-1-ylmethyl)hept-2-en-4-yn-1-amine Openeye Name: 2-hydroxybutanedioic acid; (E)-N,6,6-trimethyl-N-(1-naphthylmethyl)hept-2-en-4-yn-1-amine CAS Name: 2-hydroxybutanedioic acid; (E)-N,6,6-trimethyl-N-(1-naphthalenylmethyl)-1-hept-2-en-4-ynamine IUPAC Name: 2-hydroxybutanedioic acid; (E)-N,6,6-trimethyl-N-(naphthalen-1-ylmethyl)hept-2-en-4-yn-1-amine Traditional Name: [(E)-6,6-dimethylhept-2-en-4-ynyl]-methyl-(1-naphthylmethyl)amine; malic acid Formula: C25H31NO5 MolecularWeight: 425.51734

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C#CC=CCN(C)CC1=CC=CC2=CC=CC=C21.C(C(C(=O)O)O)C(=O)O

Isomeric SMILES

CC(C)(C)C#C/C=C/CN(C)CC1=CC=CC2=CC=CC=C21.C(C(C(=O)O)O)C(=O)O

InChI

InChI=1S/C21H25N.C4H6O5/c1-21(2,3)15-8-5-9-16-22(4)17-19-13-10-12-18-11-6-7-14-20(18)19;5-2(4(8)9)1-3(6)7/h5-7,9-14H,16-17H2,1-4H3;2,5H,1H2,(H,6,7)(H,8,9)/b9-5+;