4-(4-chlorophenyl)-N-[2-[(4-phenylpiperazin-1-yl)methyl]quinolin-6-yl]benzamide

Systemtic Name: 4-(4-chlorophenyl)-N-[2-[(4-phenylpiperazin-1-yl)methyl]quinolin-6-yl]benzamide Openeye Name: 4-(4-chlorophenyl)-N-[2-[(4-phenylpiperazin-1-yl)methyl]-6-quinolyl]benzamide CAS Name: 4-(4-chlorophenyl)-N-[2-[(4-phenyl-1-piperazinyl)methyl]-6-quinolinyl]benzamide IUPAC Name: 4-(4-chlorophenyl)-N-[2-[(4-phenylpiperazin-1-yl)methyl]quinolin-6-yl]benzamide Traditional Name: 4-(4-chlorophenyl)-N-[2-[(4-phenylpiperazino)methyl]-6-quinolyl]benzamide Formula: C33H29ClN4O MolecularWeight: 533.06256

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC3=C(C=C2)C=C(C=C3)NC(=O)C4=CC=C(C=C4)C5=CC=C(C=C5)Cl)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1CC2=NC3=C(C=C2)C=C(C=C3)NC(=O)C4=CC=C(C=C4)C5=CC=C(C=C5)Cl)C6=CC=CC=C6

InChI

InChI=1S/C33H29ClN4O/c34-28-13-10-25(11-14-28)24-6-8-26(9-7-24)33(39)36-29-16-17-32-27(22-29)12-15-30(35-32)23-37-18-20-38(21-19-37)31-4-2-1-3-5-31/h1-17,22H,18-21,23H2,(H,36,39)