[8-chloranyl-1-(4-chlorophenyl)sulfonyl-4-cyano-2,3-dihydro-1-benzazepin-5-yl] 4-tert-butylbenzoate

Systemtic Name: [8-chloranyl-1-(4-chlorophenyl)sulfonyl-4-cyano-2,3-dihydro-1-benzazepin-5-yl] 4-tert-butylbenzoate Openeye Name: [8-chloro-1-(4-chlorophenyl)sulfonyl-4-cyano-2,3-dihydro-1-benzazepin-5-yl] 4-tert-butylbenzoate CAS Name: 4-tert-butylbenzoic acid [8-chloro-1-(4-chlorophenyl)sulfonyl-4-cyano-2,3-dihydro-1-benzazepin-5-yl] ester IUPAC Name: [8-chloro-1-(4-chlorophenyl)sulfonyl-4-cyano-2,3-dihydro-1-benzazepin-5-yl] 4-tert-butylbenzoate Traditional Name: 4-tert-butylbenzoic acid [8-chloro-1-(4-chlorophenyl)sulfonyl-4-cyano-2,3-dihydro-1-benzazepin-5-yl] ester Formula: C28H24Cl2N2O4S MolecularWeight: 555.47216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)OC2=C(CCN(C3=C2C=CC(=C3)Cl)S(=O)(=O)C4=CC=C(C=C4)Cl)C#N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)OC2=C(CCN(C3=C2C=CC(=C3)Cl)S(=O)(=O)C4=CC=C(C=C4)Cl)C#N

InChI

InChI=1S/C28H24Cl2N2O4S/c1-28(2,3)20-6-4-18(5-7-20)27(33)36-26-19(17-31)14-15-32(25-16-22(30)10-13-24(25)26)37(34,35)23-11-8-21(29)9-12-23/h4-13,16H,14-15H2,1-3H3