2-[3-chloranyl-4-(3-phenylpropoxy)phenyl]ethanoic acid; cyclohexanamine

Systemtic Name: 2-[3-chloranyl-4-(3-phenylpropoxy)phenyl]ethanoic acid; cyclohexanamine Openeye Name: 2-[3-chloro-4-(3-phenylpropoxy)phenyl]acetic acid; cyclohexanamine CAS Name: 2-[3-chloro-4-(3-phenylpropoxy)phenyl]acetic acid; cyclohexanamine IUPAC Name: 2-[3-chloro-4-(3-phenylpropoxy)phenyl]acetic acid; cyclohexanamine Traditional Name: 2-[3-chloro-4-(3-phenylpropoxy)phenyl]acetic acid; cyclohexylamine Formula: C23H30ClNO3 MolecularWeight: 403.9422

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N.C1=CC=C(C=C1)CCCOC2=C(C=C(C=C2)CC(=O)O)Cl

Isomeric SMILES

C1CCC(CC1)N.C1=CC=C(C=C1)CCCOC2=C(C=C(C=C2)CC(=O)O)Cl

InChI

InChI=1S/C17H17ClO3.C6H13N/c18-15-11-14(12-17(19)20)8-9-16(15)21-10-4-7-13-5-2-1-3-6-13;7-6-4-2-1-3-5-6/h1-3,5-6,8-9,11H,4,7,10,12H2,(H,19,20);6H,1-5,7H2