3-chloranylaniline; 3-[(4-chlorophenyl)methyl]-2-(1-oxidanylidene-1-phenyl-propan-2-yl)quinazolin-4-one

Systemtic Name: 3-chloranylaniline; 3-[(4-chlorophenyl)methyl]-2-(1-oxidanylidene-1-phenyl-propan-2-yl)quinazolin-4-one Openeye Name: 3-chloroaniline; 3-[(4-chlorophenyl)methyl]-2-(1-methyl-2-oxo-2-phenyl-ethyl)quinazolin-4-one CAS Name: 3-chloroaniline; 3-[(4-chlorophenyl)methyl]-2-(1-oxo-1-phenylpropan-2-yl)-4-quinazolinone IUPAC Name: 3-chloroaniline; 3-[(4-chlorophenyl)methyl]-2-(1-oxo-1-phenylpropan-2-yl)quinazolin-4-one Traditional Name: 3-(4-chlorobenzyl)-2-(2-keto-1-methyl-2-phenyl-ethyl)quinazolin-4-one; (3-chlorophenyl)amine Formula: C30H25Cl2N3O2 MolecularWeight: 530.4444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2C(=O)N1CC3=CC=C(C=C3)Cl)C(=O)C4=CC=CC=C4.C1=CC(=CC(=C1)Cl)N

Isomeric SMILES

CC(C1=NC2=CC=CC=C2C(=O)N1CC3=CC=C(C=C3)Cl)C(=O)C4=CC=CC=C4.C1=CC(=CC(=C1)Cl)N

InChI

InChI=1S/C24H19ClN2O2.C6H6ClN/c1-16(22(28)18-7-3-2-4-8-18)23-26-21-10-6-5-9-20(21)24(29)27(23)15-17-11-13-19(25)14-12-17;7-5-2-1-3-6(8)4-5/h2-14,16H,15H2,1H3;1-4H,8H2