2,4-bis(oxidanylidene)-1H-pyrimidine-6-carboxylic acid; N4-(7-chloranylquinolin-4-yl)-N1,N1-diethyl-pentane-1,4-diamine

Systemtic Name: 2,4-bis(oxidanylidene)-1H-pyrimidine-6-carboxylic acid; N4-(7-chloranylquinolin-4-yl)-N1,N1-diethyl-pentane-1,4-diamine Openeye Name: N4-(7-chloro-4-quinolyl)-N1,N1-diethyl-pentane-1,4-diamine; 2,4-dioxo-1H-pyrimidine-6-carboxylic acid CAS Name: N4-(7-chloro-4-quinolinyl)-N1,N1-diethylpentane-1,4-diamine; 2,4-dioxo-1H-pyrimidine-6-carboxylic acid IUPAC Name: 4-N-(7-chloroquinolin-4-yl)-1-N,1-N-diethylpentane-1,4-diamine; 2,4-dioxo-1H-pyrimidine-6-carboxylic acid Traditional Name: 4-[(7-chloro-4-quinolyl)amino]pentyl-diethyl-amine; orotic acid Formula: C23H30ClN5O4 MolecularWeight: 475.9684

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCC(C)NC1=C2C=CC(=CC2=NC=C1)Cl.C1=C(NC(=O)NC1=O)C(=O)O

Isomeric SMILES

CCN(CC)CCCC(C)NC1=C2C=CC(=CC2=NC=C1)Cl.C1=C(NC(=O)NC1=O)C(=O)O

InChI

InChI=1S/C18H26ClN3.C5H4N2O4/c1-4-22(5-2)12-6-7-14(3)21-17-10-11-20-18-13-15(19)8-9-16(17)18;8-3-1-2(4(9)10)6-5(11)7-3/h8-11,13-14H,4-7,12H2,1-3H3,(H,20,21);1H,(H,9,10)(H2,6,7,8,11)