methyl 4-(12-oxidanylidene-5,11-dihydroindeno[2,1-c][1,5]benzothiazepin-11-yl)benzoate

Systemtic Name: methyl 4-(12-oxidanylidene-5,11-dihydroindeno[2,1-c][1,5]benzothiazepin-11-yl)benzoate Openeye Name: methyl 4-(12-oxo-5,11-dihydroindeno[2,1-c][1,5]benzothiazepin-11-yl)benzoate CAS Name: 4-(12-oxo-5,11-dihydroindeno[2,1-c][1,5]benzothiazepin-11-yl)benzoic acid methyl ester IUPAC Name: methyl 4-(12-oxo-5,11-dihydroindeno[2,1-c][1,5]benzothiazepin-11-yl)benzoate Traditional Name: 4-(12-keto-5,11-dihydroindeno[2,1-c][1,5]benzothiazepin-11-yl)benzoic acid methyl ester Formula: C24H17NO3S MolecularWeight: 399.46168

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2C3=C(C4=CC=CC=C4C3=O)NC5=CC=CC=C5S2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2C3=C(C4=CC=CC=C4C3=O)NC5=CC=CC=C5S2

InChI

InChI=1S/C24H17NO3S/c1-28-24(27)15-12-10-14(11-13-15)23-20-21(16-6-2-3-7-17(16)22(20)26)25-18-8-4-5-9-19(18)29-23/h2-13,23,25H,1H3