ethyl 4-[4-(1,2-dihydroacenaphthylen-5-ylcarbamoyl)phenyl]sulfonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[4-(1,2-dihydroacenaphthylen-5-ylcarbamoyl)phenyl]sulfonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[4-(1,2-dihydroacenaphthylen-5-ylcarbamoyl)phenyl]sulfonylpiperazine-1-carboxylate CAS Name: 4-[4-[(1,2-dihydroacenaphthylen-5-ylamino)-oxomethyl]phenyl]sulfonyl-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(1,2-dihydroacenaphthylen-5-ylcarbamoyl)phenyl]sulfonylpiperazine-1-carboxylate Traditional Name: 4-[4-(acenaphthen-5-ylcarbamoyl)phenyl]sulfonylpiperazine-1-carboxylic acid ethyl ester Formula: C26H27N3O5S MolecularWeight: 493.57468

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C4C=CC=C5C4=C(CC5)C=C3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C4C=CC=C5C4=C(CC5)C=C3

InChI

InChI=1S/C26H27N3O5S/c1-2-34-26(31)28-14-16-29(17-15-28)35(32,33)21-11-8-20(9-12-21)25(30)27-23-13-10-19-7-6-18-4-3-5-22(23)24(18)19/h3-5,8-13H,2,6-7,14-17H2,1H3,(H,27,30)