3'-chloranyl-6'-[(phenylmethyl)amino]spiro[1-benzofuran-3,9'-xanthene]-2-one

Systemtic Name: 3'-chloranyl-6'-[(phenylmethyl)amino]spiro[1-benzofuran-3,9'-xanthene]-2-one Openeye Name: 3'-(benzylamino)-6'-chloro-spiro[benzofuran-3,9'-xanthene]-2-one CAS Name: 3'-chloro-6'-[(phenylmethyl)amino]-2-spiro[benzofuran-3,9'-xanthene]one IUPAC Name: 3'-(benzylamino)-6'-chlorospiro[1-benzofuran-3,9'-xanthene]-2-one Traditional Name: 3'-(benzylamino)-6'-chloro-spiro[coumaran-3,9'-xanthene]-2-one Formula: C27H18ClNO3 MolecularWeight: 439.88972

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=CC3=C(C=C2)C4(C5=C(O3)C=C(C=C5)Cl)C6=CC=CC=C6OC4=O

Isomeric SMILES

C1=CC=C(C=C1)CNC2=CC3=C(C=C2)C4(C5=C(O3)C=C(C=C5)Cl)C6=CC=CC=C6OC4=O

InChI

InChI=1S/C27H18ClNO3/c28-18-10-12-21-24(14-18)31-25-15-19(29-16-17-6-2-1-3-7-17)11-13-22(25)27(21)20-8-4-5-9-23(20)32-26(27)30/h1-15,29H,16H2