4-(butylamino)-2-[butylamino-(4-methoxyphenyl)methyl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(butylamino)-2-[butylamino-(4-methoxyphenyl)methyl]-4-oxidanylidene-butanoic acid Openeye Name: 4-(butylamino)-2-[butylamino-(4-methoxyphenyl)methyl]-4-oxo-butanoic acid CAS Name: 4-(butylamino)-2-[butylamino-(4-methoxyphenyl)methyl]-4-oxobutanoic acid IUPAC Name: 4-(butylamino)-2-[butylamino-(4-methoxyphenyl)methyl]-4-oxobutanoic acid Traditional Name: 4-(butylamino)-2-[butylamino-(4-methoxyphenyl)methyl]-4-keto-butyric acid Formula: C20H32N2O4 MolecularWeight: 364.47908

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(C1=CC=C(C=C1)OC)C(CC(=O)NCCCC)C(=O)O

Isomeric SMILES

CCCCNC(C1=CC=C(C=C1)OC)C(CC(=O)NCCCC)C(=O)O

InChI

InChI=1S/C20H32N2O4/c1-4-6-12-21-18(23)14-17(20(24)25)19(22-13-7-5-2)15-8-10-16(26-3)11-9-15/h8-11,17,19,22H,4-7,12-14H2,1-3H3,(H,21,23)(H,24,25)