4-[(4-butylphenyl)amino]-2-(3-methoxypropylamino)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(4-butylphenyl)amino]-2-(3-methoxypropylamino)-4-oxidanylidene-butanoic acid Openeye Name: 4-(4-butylanilino)-2-(3-methoxypropylamino)-4-oxo-butanoic acid CAS Name: 4-(4-butylanilino)-2-(3-methoxypropylamino)-4-oxobutanoic acid IUPAC Name: 4-(4-butylanilino)-2-(3-methoxypropylamino)-4-oxobutanoic acid Traditional Name: 4-(4-butylanilino)-4-keto-2-(3-methoxypropylamino)butyric acid Formula: C18H28N2O4 MolecularWeight: 336.42592

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)CC(C(=O)O)NCCCOC

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)CC(C(=O)O)NCCCOC

InChI

InChI=1S/C18H28N2O4/c1-3-4-6-14-7-9-15(10-8-14)20-17(21)13-16(18(22)23)19-11-5-12-24-2/h7-10,16,19H,3-6,11-13H2,1-2H3,(H,20,21)(H,22,23)