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benzoic acid; heptan-2-amine

benzoic acid; heptan-2-amine

Systemtic Name:benzoic acid; heptan-2-amine
Openeye Name:benzoic acid; heptan-2-amine
CAS Name:benzoic acid; 2-heptanamine
IUPAC Name:benzoic acid; heptan-2-amine
Traditional Name:benzoic acid; 1-methylhexylamine
Formula: C14H23NO2
MolecularWeight: 237.33792
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)N.C1=CC=C(C=C1)C(=O)O


Isomeric SMILES

CCCCCC(C)N.C1=CC=C(C=C1)C(=O)O


InChI

InChI=1S/C7H17N.C7H6O2/c1-3-4-5-6-7(2)8;8-7(9)6-4-2-1-3-5-6/h7H,3-6,8H2,1-2H3;1-5H,(H,8,9)


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