4-[4-[4-(aminomethyl)cyclohexyl]carbonylphenyl]butanoic acid

Systemtic Name: 4-[4-[4-(aminomethyl)cyclohexyl]carbonylphenyl]butanoic acid Openeye Name: 4-[4-[4-(aminomethyl)cyclohexanecarbonyl]phenyl]butanoic acid CAS Name: 4-[4-[[4-(aminomethyl)cyclohexyl]-oxomethyl]phenyl]butanoic acid IUPAC Name: 4-[4-[4-(aminomethyl)cyclohexanecarbonyl]phenyl]butanoic acid Traditional Name: 4-[4-[4-(aminomethyl)cyclohexanecarbonyl]phenyl]butyric acid Formula: C18H25NO3 MolecularWeight: 303.396

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CN)C(=O)C2=CC=C(C=C2)CCCC(=O)O

Isomeric SMILES

C1CC(CCC1CN)C(=O)C2=CC=C(C=C2)CCCC(=O)O

InChI

InChI=1S/C18H25NO3/c19-12-14-6-10-16(11-7-14)18(22)15-8-4-13(5-9-15)2-1-3-17(20)21/h4-5,8-9,14,16H,1-3,6-7,10-12,19H2,(H,20,21)