7-chloranyl-3-[4-(diethylamino)phenyl]-3-methyl-1-(phenylmethyl)-5-piperazin-1-yl-quinoline-2,4-dione

Systemtic Name: 7-chloranyl-3-[4-(diethylamino)phenyl]-3-methyl-1-(phenylmethyl)-5-piperazin-1-yl-quinoline-2,4-dione Openeye Name: 1-benzyl-7-chloro-3-[4-(diethylamino)phenyl]-3-methyl-5-piperazin-1-yl-quinoline-2,4-dione CAS Name: 7-chloro-3-[4-(diethylamino)phenyl]-3-methyl-1-(phenylmethyl)-5-(1-piperazinyl)quinoline-2,4-dione IUPAC Name: 1-benzyl-7-chloro-3-[4-(diethylamino)phenyl]-3-methyl-5-piperazin-1-ylquinoline-2,4-dione Traditional Name: 1-benzyl-7-chloro-3-[4-(diethylamino)phenyl]-3-methyl-5-piperazino-quinoline-2,4-quinone Formula: C31H35ClN4O2 MolecularWeight: 531.0882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C2(C(=O)C3=C(C=C(C=C3N(C2=O)CC4=CC=CC=C4)Cl)N5CCNCC5)C

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C2(C(=O)C3=C(C=C(C=C3N(C2=O)CC4=CC=CC=C4)Cl)N5CCNCC5)C

InChI

InChI=1S/C31H35ClN4O2/c1-4-34(5-2)25-13-11-23(12-14-25)31(3)29(37)28-26(35-17-15-33-16-18-35)19-24(32)20-27(28)36(30(31)38)21-22-9-7-6-8-10-22/h6-14,19-20,33H,4-5,15-18,21H2,1-3H3