tert-butyl 4-[3-(6-chloranylnaphthalen-2-yl)sulfonylpropanoyl]-3-(2-ethoxy-2-oxidanylidene-ethyl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[3-(6-chloranylnaphthalen-2-yl)sulfonylpropanoyl]-3-(2-ethoxy-2-oxidanylidene-ethyl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-[3-[(6-chloro-2-naphthyl)sulfonyl]propanoyl]-3-(2-ethoxy-2-oxo-ethyl)piperazine-1-carboxylate CAS Name: 4-[3-[(6-chloro-2-naphthalenyl)sulfonyl]-1-oxopropyl]-3-(2-ethoxy-2-oxoethyl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-(6-chloronaphthalen-2-yl)sulfonylpropanoyl]-3-(2-ethoxy-2-oxoethyl)piperazine-1-carboxylate Traditional Name: 4-[3-[(6-chloro-2-naphthyl)sulfonyl]propanoyl]-3-(2-ethoxy-2-keto-ethyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C26H33ClN2O7S MolecularWeight: 553.06742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1CN(CCN1C(=O)CCS(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Cl)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)CC1CN(CCN1C(=O)CCS(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Cl)C(=O)OC(C)(C)C

InChI

InChI=1S/C26H33ClN2O7S/c1-5-35-24(31)16-21-17-28(25(32)36-26(2,3)4)11-12-29(21)23(30)10-13-37(33,34)22-9-7-18-14-20(27)8-6-19(18)15-22/h6-9,14-15,21H,5,10-13,16-17H2,1-4H3