3-[4-(3-chloranyl-4-methyl-phenyl)piperazin-1-yl]carbonyl-6-methoxy-chromen-2-one

Systemtic Name: 3-[4-(3-chloranyl-4-methyl-phenyl)piperazin-1-yl]carbonyl-6-methoxy-chromen-2-one Openeye Name: 3-[4-(3-chloro-4-methyl-phenyl)piperazine-1-carbonyl]-6-methoxy-chromen-2-one CAS Name: 3-[[4-(3-chloro-4-methylphenyl)-1-piperazinyl]-oxomethyl]-6-methoxy-1-benzopyran-2-one IUPAC Name: 3-[4-(3-chloro-4-methylphenyl)piperazine-1-carbonyl]-6-methoxychromen-2-one Traditional Name: 3-[4-(3-chloro-4-methyl-phenyl)piperazine-1-carbonyl]-6-methoxy-coumarin Formula: C22H21ClN2O4 MolecularWeight: 412.86614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CCN(CC2)C(=O)C3=CC4=C(C=CC(=C4)OC)OC3=O)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2CCN(CC2)C(=O)C3=CC4=C(C=CC(=C4)OC)OC3=O)Cl

InChI

InChI=1S/C22H21ClN2O4/c1-14-3-4-16(13-19(14)23)24-7-9-25(10-8-24)21(26)18-12-15-11-17(28-2)5-6-20(15)29-22(18)27/h3-6,11-13H,7-10H2,1-2H3