2-[2-[(E)-2-(4-chlorophenyl)ethenyl]-6-phenylmethoxy-quinazolin-4-yl]cyclohexane-1,1-diamine

Systemtic Name: 2-[2-[(E)-2-(4-chlorophenyl)ethenyl]-6-phenylmethoxy-quinazolin-4-yl]cyclohexane-1,1-diamine Openeye Name: 2-[6-benzyloxy-2-[(E)-2-(4-chlorophenyl)vinyl]quinazolin-4-yl]cyclohexane-1,1-diamine CAS Name: 2-[2-[(E)-2-(4-chlorophenyl)ethenyl]-6-phenylmethoxy-4-quinazolinyl]cyclohexane-1,1-diamine IUPAC Name: 2-[2-[(E)-2-(4-chlorophenyl)ethenyl]-6-phenylmethoxyquinazolin-4-yl]cyclohexane-1,1-diamine Traditional Name: [1-amino-2-[6-benzoxy-2-[(E)-2-(4-chlorophenyl)vinyl]quinazolin-4-yl]cyclohexyl]amine Formula: C29H29ClN4O MolecularWeight: 485.01976

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C2=NC(=NC3=C2C=C(C=C3)OCC4=CC=CC=C4)C=CC5=CC=C(C=C5)Cl)(N)N

Isomeric SMILES

C1CCC(C(C1)C2=NC(=NC3=C2C=C(C=C3)OCC4=CC=CC=C4)/C=C/C5=CC=C(C=C5)Cl)(N)N

InChI

InChI=1S/C29H29ClN4O/c30-22-12-9-20(10-13-22)11-16-27-33-26-15-14-23(35-19-21-6-2-1-3-7-21)18-24(26)28(34-27)25-8-4-5-17-29(25,31)32/h1-3,6-7,9-16,18,25H,4-5,8,17,19,31-32H2/b16-11+