ethyl 1-[2-[(4-chlorophenyl)sulfonylamino]-1,2-dihydroacenaphthylen-1-yl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[(4-chlorophenyl)sulfonylamino]-1,2-dihydroacenaphthylen-1-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[(4-chlorophenyl)sulfonylamino]-1,2-dihydroacenaphthylen-1-yl]piperidine-4-carboxylate CAS Name: 1-[2-[(4-chlorophenyl)sulfonylamino]-1,2-dihydroacenaphthylen-1-yl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[(4-chlorophenyl)sulfonylamino]-1,2-dihydroacenaphthylen-1-yl]piperidine-4-carboxylate Traditional Name: 1-[2-[(4-chlorophenyl)sulfonylamino]acenaphthen-1-yl]isonipecotic acid ethyl ester Formula: C26H27ClN2O4S MolecularWeight: 499.02158

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2C(C3=CC=CC4=C3C2=CC=C4)NS(=O)(=O)C5=CC=C(C=C5)Cl

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2C(C3=CC=CC4=C3C2=CC=C4)NS(=O)(=O)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C26H27ClN2O4S/c1-2-33-26(30)18-13-15-29(16-14-18)25-22-8-4-6-17-5-3-7-21(23(17)22)24(25)28-34(31,32)20-11-9-19(27)10-12-20/h3-12,18,24-25,28H,2,13-16H2,1H3