[9-chloranyl-5-(2,3-dihydro-1H-inden-5-yl)-3-methyl-8-thiophen-2-ylcarbonyloxy-1,2,4,5-tetrahydro-3-benzazepin-7-yl] thiophene-2-carboxylate

Systemtic Name: [9-chloranyl-5-(2,3-dihydro-1H-inden-5-yl)-3-methyl-8-thiophen-2-ylcarbonyloxy-1,2,4,5-tetrahydro-3-benzazepin-7-yl] thiophene-2-carboxylate Openeye Name: [9-chloro-5-indan-5-yl-3-methyl-8-(thiophene-2-carbonyloxy)-1,2,4,5-tetrahydro-3-benzazepin-7-yl] thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid [9-chloro-5-(2,3-dihydro-1H-inden-5-yl)-3-methyl-8-[oxo(thiophen-2-yl)methoxy]-1,2,4,5-tetrahydro-3-benzazepin-7-yl] ester IUPAC Name: [9-chloro-5-(2,3-dihydro-1H-inden-5-yl)-3-methyl-8-(thiophene-2-carbonyloxy)-1,2,4,5-tetrahydro-3-benzazepin-7-yl] thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid [9-chloro-5-indan-5-yl-3-methyl-8-(2-thenoyloxy)-1,2,4,5-tetrahydro-3-benzazepin-7-yl] ester Formula: C30H26ClNO4S2 MolecularWeight: 564.11474

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C(C(=C(C=C2C(C1)C3=CC4=C(CCC4)C=C3)OC(=O)C5=CC=CS5)OC(=O)C6=CC=CS6)Cl

Isomeric SMILES

CN1CCC2=C(C(=C(C=C2C(C1)C3=CC4=C(CCC4)C=C3)OC(=O)C5=CC=CS5)OC(=O)C6=CC=CS6)Cl

InChI

InChI=1S/C30H26ClNO4S2/c1-32-12-11-21-22(23(17-32)20-10-9-18-5-2-6-19(18)15-20)16-24(35-29(33)25-7-3-13-37-25)28(27(21)31)36-30(34)26-8-4-14-38-26/h3-4,7-10,13-16,23H,2,5-6,11-12,17H2,1H3