9-aminocarbonyl-2-[(4-chlorophenyl)methyl]-3-oxidanyl-8,10-dihydro-7H-1,9-phenanthroline-4-carboxylic acid; N,N-diethylethanamine

Systemtic Name: 9-aminocarbonyl-2-[(4-chlorophenyl)methyl]-3-oxidanyl-8,10-dihydro-7H-1,9-phenanthroline-4-carboxylic acid; N,N-diethylethanamine Openeye Name: 9-carbamoyl-2-[(4-chlorophenyl)methyl]-3-hydroxy-8,10-dihydro-7H-1,9-phenanthroline-4-carboxylic acid; N,N-diethylethanamine CAS Name: 9-carbamoyl-2-[(4-chlorophenyl)methyl]-3-hydroxy-8,10-dihydro-7H-1,9-phenanthroline-4-carboxylic acid; N,N-diethylethanamine IUPAC Name: 9-carbamoyl-2-[(4-chlorophenyl)methyl]-3-hydroxy-8,10-dihydro-7H-1,9-phenanthroline-4-carboxylic acid; N,N-diethylethanamine Traditional Name: 9-carbamoyl-2-(4-chlorobenzyl)-3-hydroxy-8,10-dihydro-7H-1,9-phenanthroline-4-carboxylic acid; triethylamine Formula: C27H33ClN4O4 MolecularWeight: 513.02832

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC.C1CN(CC2=C1C=CC3=C(C(=C(N=C23)CC4=CC=C(C=C4)Cl)O)C(=O)O)C(=O)N

Isomeric SMILES

CCN(CC)CC.C1CN(CC2=C1C=CC3=C(C(=C(N=C23)CC4=CC=C(C=C4)Cl)O)C(=O)O)C(=O)N

InChI

InChI=1S/C21H18ClN3O4.C6H15N/c22-13-4-1-11(2-5-13)9-16-19(26)17(20(27)28)14-6-3-12-7-8-25(21(23)29)10-15(12)18(14)24-16;1-4-7(5-2)6-3/h1-6,26H,7-10H2,(H2,23,29)(H,27,28);4-6H2,1-3H3