1-[1-(4-chlorophenyl)cyclobutyl]-3-methyl-butan-1-amine; 2-oxidanylpropane-1,2,3-tricarboxylic acid

Systemtic Name: 1-[1-(4-chlorophenyl)cyclobutyl]-3-methyl-butan-1-amine; 2-oxidanylpropane-1,2,3-tricarboxylic acid Openeye Name: 1-[1-(4-chlorophenyl)cyclobutyl]-3-methyl-butan-1-amine; citric acid CAS Name: 1-[1-(4-chlorophenyl)cyclobutyl]-3-methyl-1-butanamine; 2-hydroxypropane-1,2,3-tricarboxylic acid IUPAC Name: 1-[1-(4-chlorophenyl)cyclobutyl]-3-methylbutan-1-amine; 2-hydroxypropane-1,2,3-tricarboxylic acid Traditional Name: [1-[1-(4-chlorophenyl)cyclobutyl]-3-methyl-butyl]amine; citric acid Formula: C21H30ClNO7 MolecularWeight: 443.9184

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1(CCC1)C2=CC=C(C=C2)Cl)N.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

Isomeric SMILES

CC(C)CC(C1(CCC1)C2=CC=C(C=C2)Cl)N.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

InChI

InChI=1S/C15H22ClN.C6H8O7/c1-11(2)10-14(17)15(8-3-9-15)12-4-6-13(16)7-5-12;7-3(8)1-6(13,5(11)12)2-4(9)10/h4-7,11,14H,3,8-10,17H2,1-2H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)