3-[(2R)-2-anthracen-9-yl-2,3-dihydro-1,5-benzothiazepin-4-yl]chromen-2-one

Systemtic Name: 3-[(2R)-2-anthracen-9-yl-2,3-dihydro-1,5-benzothiazepin-4-yl]chromen-2-one Openeye Name: 3-[(2R)-2-(9-anthryl)-2,3-dihydro-1,5-benzothiazepin-4-yl]chromen-2-one CAS Name: 3-[(2R)-2-(9-anthracenyl)-2,3-dihydro-1,5-benzothiazepin-4-yl]-1-benzopyran-2-one IUPAC Name: 3-[(2R)-2-anthracen-9-yl-2,3-dihydro-1,5-benzothiazepin-4-yl]chromen-2-one Traditional Name: 3-[(2R)-2-(9-anthryl)-2,3-dihydro-1,5-benzothiazepin-4-yl]coumarin Formula: C32H21NO2S MolecularWeight: 483.57964

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Descriptors Computed from Structure

Canonical SMILES:

C1C(SC2=CC=CC=C2N=C1C3=CC4=CC=CC=C4OC3=O)C5=C6C=CC=CC6=CC7=CC=CC=C75

Isomeric SMILES

C1[C@@H](SC2=CC=CC=C2N=C1C3=CC4=CC=CC=C4OC3=O)C5=C6C=CC=CC6=CC7=CC=CC=C75

InChI

InChI=1S/C32H21NO2S/c34-32-25(18-22-11-3-7-15-28(22)35-32)27-19-30(36-29-16-8-6-14-26(29)33-27)31-23-12-4-1-9-20(23)17-21-10-2-5-13-24(21)31/h1-18,30H,19H2/t30-/m1/s1