tert-butyl 4-[2-[4-(6-chloranylnaphthalen-2-yl)sulfonyl-2-oxidanylidene-piperazin-1-yl]ethyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-[4-(6-chloranylnaphthalen-2-yl)sulfonyl-2-oxidanylidene-piperazin-1-yl]ethyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-[4-[(6-chloro-2-naphthyl)sulfonyl]-2-oxo-piperazin-1-yl]ethyl]piperidine-1-carboxylate CAS Name: 4-[2-[4-[(6-chloro-2-naphthalenyl)sulfonyl]-2-oxo-1-piperazinyl]ethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-[4-(6-chloronaphthalen-2-yl)sulfonyl-2-oxopiperazin-1-yl]ethyl]piperidine-1-carboxylate Traditional Name: 4-[2-[4-[(6-chloro-2-naphthyl)sulfonyl]-2-keto-piperazino]ethyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C26H34ClN3O5S MolecularWeight: 536.08326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)CCN2CCN(CC2=O)S(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)CCN2CCN(CC2=O)S(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl

InChI

InChI=1S/C26H34ClN3O5S/c1-26(2,3)35-25(32)29-12-9-19(10-13-29)8-11-28-14-15-30(18-24(28)31)36(33,34)23-7-5-20-16-22(27)6-4-21(20)17-23/h4-7,16-17,19H,8-15,18H2,1-3H3