6-[[(4-chloranyl-2,5-dimethoxy-phenyl)amino]methyl]-7-oxidanyl-2,3-dihydro-1H-cyclopenta[c]chromen-4-one

Systemtic Name: 6-[[(4-chloranyl-2,5-dimethoxy-phenyl)amino]methyl]-7-oxidanyl-2,3-dihydro-1H-cyclopenta[c]chromen-4-one Openeye Name: 6-[(4-chloro-2,5-dimethoxy-anilino)methyl]-7-hydroxy-2,3-dihydro-1H-cyclopenta[c]chromen-4-one CAS Name: 6-[(4-chloro-2,5-dimethoxyanilino)methyl]-7-hydroxy-2,3-dihydro-1H-cyclopenta[c][1]benzopyran-4-one IUPAC Name: 6-[(4-chloro-2,5-dimethoxyanilino)methyl]-7-hydroxy-2,3-dihydro-1H-cyclopenta[c]chromen-4-one Traditional Name: 6-[(4-chloro-2,5-dimethoxy-anilino)methyl]-7-hydroxy-2,3-dihydro-1H-cyclopenta[c]chromen-4-one Formula: C21H20ClNO5 MolecularWeight: 401.8402

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NCC2=C(C=CC3=C2OC(=O)C4=C3CCC4)O)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NCC2=C(C=CC3=C2OC(=O)C4=C3CCC4)O)OC)Cl

InChI

InChI=1S/C21H20ClNO5/c1-26-18-9-16(19(27-2)8-15(18)22)23-10-14-17(24)7-6-12-11-4-3-5-13(11)21(25)28-20(12)14/h6-9,23-24H,3-5,10H2,1-2H3