3-(4-chlorophenyl)-3-(9H-xanthen-9-ylcarbonylamino)propanoic acid

Systemtic Name: 3-(4-chlorophenyl)-3-(9H-xanthen-9-ylcarbonylamino)propanoic acid Openeye Name: 3-(4-chlorophenyl)-3-(9H-xanthene-9-carbonylamino)propanoic acid CAS Name: 3-(4-chlorophenyl)-3-[[oxo(9H-xanthen-9-yl)methyl]amino]propanoic acid IUPAC Name: 3-(4-chlorophenyl)-3-(9H-xanthene-9-carbonylamino)propanoic acid Traditional Name: 3-(4-chlorophenyl)-3-(9H-xanthene-9-carbonylamino)propionic acid Formula: C23H18ClNO4 MolecularWeight: 407.84632

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)C(=O)NC(CC(=O)O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)C(=O)NC(CC(=O)O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H18ClNO4/c24-15-11-9-14(10-12-15)18(13-21(26)27)25-23(28)22-16-5-1-3-7-19(16)29-20-8-4-2-6-17(20)22/h1-12,18,22H,13H2,(H,25,28)(H,26,27)