3-[4-[3-[4-(aminomethyl)phenyl]-2-oxidanylidene-imidazolidin-1-yl]phenyl]pentanedioic acid

Systemtic Name: 3-[4-[3-[4-(aminomethyl)phenyl]-2-oxidanylidene-imidazolidin-1-yl]phenyl]pentanedioic acid Openeye Name: 3-[4-[3-[4-(aminomethyl)phenyl]-2-oxo-imidazolidin-1-yl]phenyl]pentanedioic acid CAS Name: 3-[4-[3-[4-(aminomethyl)phenyl]-2-oxo-1-imidazolidinyl]phenyl]pentanedioic acid IUPAC Name: 3-[4-[3-[4-(aminomethyl)phenyl]-2-oxoimidazolidin-1-yl]phenyl]pentanedioic acid Traditional Name: 3-[4-[3-[4-(aminomethyl)phenyl]-2-keto-imidazolidin-1-yl]phenyl]glutaric acid Formula: C21H23N3O5 MolecularWeight: 397.42442

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)N1C2=CC=C(C=C2)CN)C3=CC=C(C=C3)C(CC(=O)O)CC(=O)O

Isomeric SMILES

C1CN(C(=O)N1C2=CC=C(C=C2)CN)C3=CC=C(C=C3)C(CC(=O)O)CC(=O)O

InChI

InChI=1S/C21H23N3O5/c22-13-14-1-5-17(6-2-14)23-9-10-24(21(23)29)18-7-3-15(4-8-18)16(11-19(25)26)12-20(27)28/h1-8,16H,9-13,22H2,(H,25,26)(H,27,28)