4-[[2-azanyl-4-(cyclohexylcarbonylamino)phenyl]amino]butanoate

Systemtic Name: 4-[[2-azanyl-4-(cyclohexylcarbonylamino)phenyl]amino]butanoate Openeye Name: 4-[2-amino-4-(cyclohexanecarbonylamino)anilino]butanoate CAS Name: 4-[2-amino-4-[[cyclohexyl(oxo)methyl]amino]anilino]butanoate IUPAC Name: 4-[2-amino-4-(cyclohexanecarbonylamino)anilino]butanoate Traditional Name: 4-[2-amino-4-(cyclohexanecarbonylamino)anilino]butyrate Formula: C17H24N3O3- MolecularWeight: 318.39076

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2=CC(=C(C=C2)NCCCC(=O)[O-])N

Isomeric SMILES

C1CCC(CC1)C(=O)NC2=CC(=C(C=C2)NCCCC(=O)[O-])N

InChI

InChI=1S/C17H25N3O3/c18-14-11-13(20-17(23)12-5-2-1-3-6-12)8-9-15(14)19-10-4-7-16(21)22/h8-9,11-12,19H,1-7,10,18H2,(H,20,23)(H,21,22)/p-1