2-azanyl-4-(2-chlorophenyl)-3-(4-methylphenyl)carbonyl-4,6,7,8-tetrahydrochromen-5-one

Systemtic Name: 2-azanyl-4-(2-chlorophenyl)-3-(4-methylphenyl)carbonyl-4,6,7,8-tetrahydrochromen-5-one Openeye Name: 2-amino-4-(2-chlorophenyl)-3-(4-methylbenzoyl)-4,6,7,8-tetrahydrochromen-5-one CAS Name: 2-amino-4-(2-chlorophenyl)-3-[(4-methylphenyl)-oxomethyl]-4,6,7,8-tetrahydro-1-benzopyran-5-one IUPAC Name: 2-amino-4-(2-chlorophenyl)-3-(4-methylbenzoyl)-4,6,7,8-tetrahydrochromen-5-one Traditional Name: 2-amino-4-(2-chlorophenyl)-3-p-toluoyl-4,6,7,8-tetrahydrochromen-5-one Formula: C23H20ClNO3 MolecularWeight: 393.8628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=C(OC3=C(C2C4=CC=CC=C4Cl)C(=O)CCC3)N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=C(OC3=C(C2C4=CC=CC=C4Cl)C(=O)CCC3)N

InChI

InChI=1S/C23H20ClNO3/c1-13-9-11-14(12-10-13)22(27)21-19(15-5-2-3-6-16(15)24)20-17(26)7-4-8-18(20)28-23(21)25/h2-3,5-6,9-12,19H,4,7-8,25H2,1H3