5-methyl-4-phenylazanyl-7-pyrrolidin-1-yl-spiro[2-benzofuran-3,9'-xanthene]-1-one

Systemtic Name: 5-methyl-4-phenylazanyl-7-pyrrolidin-1-yl-spiro[2-benzofuran-3,9'-xanthene]-1-one Openeye Name: 4-anilino-5-methyl-7-pyrrolidin-1-yl-spiro[isobenzofuran-3,9'-xanthene]-1-one CAS Name: 4-anilino-5-methyl-7-(1-pyrrolidinyl)-1-spiro[isobenzofuran-3,9'-xanthene]one IUPAC Name: 4-anilino-5-methyl-7-pyrrolidin-1-ylspiro[2-benzofuran-3,9'-xanthene]-1-one Traditional Name: 4-anilino-5-methyl-7-pyrrolidino-spiro[phthalan-3,9'-xanthene]-1-one Formula: C31H26N2O3 MolecularWeight: 474.54974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1NC3=CC=CC=C3)C4(C5=CC=CC=C5OC6=CC=CC=C64)OC2=O)N7CCCC7

Isomeric SMILES

CC1=CC(=C2C(=C1NC3=CC=CC=C3)C4(C5=CC=CC=C5OC6=CC=CC=C64)OC2=O)N7CCCC7

InChI

InChI=1S/C31H26N2O3/c1-20-19-24(33-17-9-10-18-33)27-28(29(20)32-21-11-3-2-4-12-21)31(36-30(27)34)22-13-5-7-15-25(22)35-26-16-8-6-14-23(26)31/h2-8,11-16,19,32H,9-10,17-18H2,1H3