3-[1-(2-chloranyl-6-methoxy-7-phenylmethoxy-quinazolin-4-yl)piperidin-4-yl]-1,6-dimethyl-quinazoline-2,4-dione

Systemtic Name: 3-[1-(2-chloranyl-6-methoxy-7-phenylmethoxy-quinazolin-4-yl)piperidin-4-yl]-1,6-dimethyl-quinazoline-2,4-dione Openeye Name: 3-[1-(7-benzyloxy-2-chloro-6-methoxy-quinazolin-4-yl)-4-piperidyl]-1,6-dimethyl-quinazoline-2,4-dione CAS Name: 3-[1-(2-chloro-6-methoxy-7-phenylmethoxy-4-quinazolinyl)-4-piperidinyl]-1,6-dimethylquinazoline-2,4-dione IUPAC Name: 3-[1-(2-chloro-6-methoxy-7-phenylmethoxyquinazolin-4-yl)piperidin-4-yl]-1,6-dimethylquinazoline-2,4-dione Traditional Name: 3-[1-(7-benzoxy-2-chloro-6-methoxy-quinazolin-4-yl)-4-piperidyl]-1,6-dimethyl-quinazoline-2,4-quinone Formula: C31H30ClN5O4 MolecularWeight: 572.054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)N(C2=O)C3CCN(CC3)C4=NC(=NC5=CC(=C(C=C54)OC)OCC6=CC=CC=C6)Cl)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)N(C2=O)C3CCN(CC3)C4=NC(=NC5=CC(=C(C=C54)OC)OCC6=CC=CC=C6)Cl)C

InChI

InChI=1S/C31H30ClN5O4/c1-19-9-10-25-23(15-19)29(38)37(31(39)35(25)2)21-11-13-36(14-12-21)28-22-16-26(40-3)27(17-24(22)33-30(32)34-28)41-18-20-7-5-4-6-8-20/h4-10,15-17,21H,11-14,18H2,1-3H3