11-(2-chloranyl-5-nitro-phenyl)-5,11-dihydroindeno[2,1-c][1,5]benzothiazepin-12-one

Systemtic Name: 11-(2-chloranyl-5-nitro-phenyl)-5,11-dihydroindeno[2,1-c][1,5]benzothiazepin-12-one Openeye Name: 11-(2-chloro-5-nitro-phenyl)-5,11-dihydroindeno[2,1-c][1,5]benzothiazepin-12-one CAS Name: 11-(2-chloro-5-nitrophenyl)-5,11-dihydroindeno[2,1-c][1,5]benzothiazepin-12-one IUPAC Name: 11-(2-chloro-5-nitrophenyl)-5,11-dihydroindeno[2,1-c][1,5]benzothiazepin-12-one Traditional Name: 11-(2-chloro-5-nitro-phenyl)-5,11-dihydroindeno[2,1-c][1,5]benzothiazepin-12-one Formula: C22H13ClN2O3S MolecularWeight: 420.86822

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(C2=O)C(SC4=CC=CC=C4N3)C5=C(C=CC(=C5)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(C2=O)C(SC4=CC=CC=C4N3)C5=C(C=CC(=C5)[N+](=O)[O-])Cl

InChI

InChI=1S/C22H13ClN2O3S/c23-16-10-9-12(25(27)28)11-15(16)22-19-20(13-5-1-2-6-14(13)21(19)26)24-17-7-3-4-8-18(17)29-22/h1-11,22,24H