3-[4-[(5-chloranyl-2-methoxy-phenyl)methyl]piperazin-1-yl]carbonylchromen-2-one

Systemtic Name: 3-[4-[(5-chloranyl-2-methoxy-phenyl)methyl]piperazin-1-yl]carbonylchromen-2-one Openeye Name: 3-[4-[(5-chloro-2-methoxy-phenyl)methyl]piperazine-1-carbonyl]chromen-2-one CAS Name: 3-[[4-[(5-chloro-2-methoxyphenyl)methyl]-1-piperazinyl]-oxomethyl]-1-benzopyran-2-one IUPAC Name: 3-[4-[(5-chloro-2-methoxyphenyl)methyl]piperazine-1-carbonyl]chromen-2-one Traditional Name: 3-[4-(5-chloro-2-methoxy-benzyl)piperazine-1-carbonyl]coumarin Formula: C22H21ClN2O4 MolecularWeight: 412.86614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)CN2CCN(CC2)C(=O)C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)CN2CCN(CC2)C(=O)C3=CC4=CC=CC=C4OC3=O

InChI

InChI=1S/C22H21ClN2O4/c1-28-19-7-6-17(23)12-16(19)14-24-8-10-25(11-9-24)21(26)18-13-15-4-2-3-5-20(15)29-22(18)27/h2-7,12-13H,8-11,14H2,1H3