3-[4-(11-cyclopentylundecylamino)phenyl]-3-oxidanylidene-propanoic acid

Systemtic Name: 3-[4-(11-cyclopentylundecylamino)phenyl]-3-oxidanylidene-propanoic acid Openeye Name: 3-[4-(11-cyclopentylundecylamino)phenyl]-3-oxo-propanoic acid CAS Name: 3-[4-(11-cyclopentylundecylamino)phenyl]-3-oxopropanoic acid IUPAC Name: 3-[4-(11-cyclopentylundecylamino)phenyl]-3-oxopropanoic acid Traditional Name: 3-[4-(11-cyclopentylundecylamino)phenyl]-3-keto-propionic acid Formula: C25H39NO3 MolecularWeight: 401.58206

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CCCCCCCCCCCNC2=CC=C(C=C2)C(=O)CC(=O)O

Isomeric SMILES

C1CCC(C1)CCCCCCCCCCCNC2=CC=C(C=C2)C(=O)CC(=O)O

InChI

InChI=1S/C25H39NO3/c27-24(20-25(28)29)22-15-17-23(18-16-22)26-19-11-7-5-3-1-2-4-6-8-12-21-13-9-10-14-21/h15-18,21,26H,1-14,19-20H2,(H,28,29)