2-(3,4-dichlorophenyl)-3-(1H-isoindol-5-ylamino)-2-phenyl-propanoic acid

Systemtic Name: 2-(3,4-dichlorophenyl)-3-(1H-isoindol-5-ylamino)-2-phenyl-propanoic acid Openeye Name: 2-(3,4-dichlorophenyl)-3-(1H-isoindol-5-ylamino)-2-phenyl-propanoic acid CAS Name: 2-(3,4-dichlorophenyl)-3-(1H-isoindol-5-ylamino)-2-phenylpropanoic acid IUPAC Name: 2-(3,4-dichlorophenyl)-3-(1H-isoindol-5-ylamino)-2-phenylpropanoic acid Traditional Name: 2-(3,4-dichlorophenyl)-3-(1H-isoindol-5-ylamino)-2-phenyl-propionic acid Formula: C23H18Cl2N2O2 MolecularWeight: 425.30722

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=C(C=C2)NCC(C3=CC=CC=C3)(C4=CC(=C(C=C4)Cl)Cl)C(=O)O)C=N1

Isomeric SMILES

C1C2=C(C=C(C=C2)NCC(C3=CC=CC=C3)(C4=CC(=C(C=C4)Cl)Cl)C(=O)O)C=N1

InChI

InChI=1S/C23H18Cl2N2O2/c24-20-9-7-18(11-21(20)25)23(22(28)29,17-4-2-1-3-5-17)14-27-19-8-6-15-12-26-13-16(15)10-19/h1-11,13,27H,12,14H2,(H,28,29)