7-[3-[(7-phenylmethoxy-3,4-dihydro-2H-chromen-2-yl)methylamino]propoxy]chromen-2-one

Systemtic Name: 7-[3-[(7-phenylmethoxy-3,4-dihydro-2H-chromen-2-yl)methylamino]propoxy]chromen-2-one Openeye Name: 7-[3-[(7-benzyloxychroman-2-yl)methylamino]propoxy]chromen-2-one CAS Name: 7-[3-[(7-phenylmethoxy-3,4-dihydro-2H-1-benzopyran-2-yl)methylamino]propoxy]-1-benzopyran-2-one IUPAC Name: 7-[3-[(7-phenylmethoxy-3,4-dihydro-2H-chromen-2-yl)methylamino]propoxy]chromen-2-one Traditional Name: 7-[3-[(7-benzoxychroman-2-yl)methylamino]propoxy]coumarin Formula: C29H29NO5 MolecularWeight: 471.54426

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=C(C=C2)OCC3=CC=CC=C3)OC1CNCCCOC4=CC5=C(C=C4)C=CC(=O)O5

Isomeric SMILES

C1CC2=C(C=C(C=C2)OCC3=CC=CC=C3)OC1CNCCCOC4=CC5=C(C=C4)C=CC(=O)O5

InChI

InChI=1S/C29H29NO5/c31-29-14-10-23-7-11-24(17-28(23)35-29)32-16-4-15-30-19-26-13-9-22-8-12-25(18-27(22)34-26)33-20-21-5-2-1-3-6-21/h1-3,5-8,10-12,14,17-18,26,30H,4,9,13,15-16,19-20H2