5-[(4-chlorophenyl)methyl]-6-oxidanylidene-phenanthridine-2-carboxylic acid

Systemtic Name: 5-[(4-chlorophenyl)methyl]-6-oxidanylidene-phenanthridine-2-carboxylic acid Openeye Name: 5-[(4-chlorophenyl)methyl]-6-oxo-phenanthridine-2-carboxylic acid CAS Name: 5-[(4-chlorophenyl)methyl]-6-oxo-2-phenanthridinecarboxylic acid IUPAC Name: 5-[(4-chlorophenyl)methyl]-6-oxophenanthridine-2-carboxylic acid Traditional Name: 5-(4-chlorobenzyl)-6-keto-phenanthridine-2-carboxylic acid Formula: C21H14ClNO3 MolecularWeight: 363.79376

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(C=CC(=C3)C(=O)O)N(C2=O)CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(C=CC(=C3)C(=O)O)N(C2=O)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H14ClNO3/c22-15-8-5-13(6-9-15)12-23-19-10-7-14(21(25)26)11-18(19)16-3-1-2-4-17(16)20(23)24/h1-11H,12H2,(H,25,26)