(1S)-1-[1-(4-chlorophenyl)cyclobutyl]-3-methyl-butan-1-amine; 2-oxidanyl-2-phenyl-ethanoic acid

Systemtic Name: (1S)-1-[1-(4-chlorophenyl)cyclobutyl]-3-methyl-butan-1-amine; 2-oxidanyl-2-phenyl-ethanoic acid Openeye Name: (1S)-1-[1-(4-chlorophenyl)cyclobutyl]-3-methyl-butan-1-amine; 2-hydroxy-2-phenyl-acetic acid CAS Name: (1S)-1-[1-(4-chlorophenyl)cyclobutyl]-3-methyl-1-butanamine; 2-hydroxy-2-phenylacetic acid IUPAC Name: (1S)-1-[1-(4-chlorophenyl)cyclobutyl]-3-methylbutan-1-amine; 2-hydroxy-2-phenylacetic acid Traditional Name: [(1S)-1-[1-(4-chlorophenyl)cyclobutyl]-3-methyl-butyl]amine; madelic acid Formula: C23H30ClNO3 MolecularWeight: 403.9422

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)C[C@@H](C1(CCC1)C2=CC=C(C=C2)Cl)N.C1=CC=C(C=C1)C(C(=O)O)O

InChI

InChI=1S/C15H22ClN.C8H8O3/c1-11(2)10-14(17)15(8-3-9-15)12-4-6-13(16)7-5-12;9-7(8(10)11)6-4-2-1-3-5-6/h4-7,11,14H,3,8-10,17H2,1-2H3;1-5,7,9H,(H,10,11)/t14-;/m0./s1