tert-butyl 2-[(6-chloranylnaphthalen-2-yl)sulfonyl-[2-oxidanylidene-1-[4-(2-oxidanylidenepyridin-1-yl)phenyl]piperidin-3-yl]amino]ethanoate

Systemtic Name: tert-butyl 2-[(6-chloranylnaphthalen-2-yl)sulfonyl-[2-oxidanylidene-1-[4-(2-oxidanylidenepyridin-1-yl)phenyl]piperidin-3-yl]amino]ethanoate Openeye Name: tert-butyl 2-[(6-chloro-2-naphthyl)sulfonyl-[2-oxo-1-[4-(2-oxo-1-pyridyl)phenyl]-3-piperidyl]amino]acetate CAS Name: 2-[(6-chloro-2-naphthalenyl)sulfonyl-[2-oxo-1-[4-(2-oxo-1-pyridinyl)phenyl]-3-piperidinyl]amino]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(6-chloronaphthalen-2-yl)sulfonyl-[2-oxo-1-[4-(2-oxopyridin-1-yl)phenyl]piperidin-3-yl]amino]acetate Traditional Name: 2-[(6-chloro-2-naphthyl)sulfonyl-[2-keto-1-[4-(2-keto-1-pyridyl)phenyl]-3-piperidyl]amino]acetic acid tert-butyl ester Formula: C32H32ClN3O6S MolecularWeight: 622.13098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN(C1CCCN(C1=O)C2=CC=C(C=C2)N3C=CC=CC3=O)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl

Isomeric SMILES

CC(C)(C)OC(=O)CN(C1CCCN(C1=O)C2=CC=C(C=C2)N3C=CC=CC3=O)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl

InChI

InChI=1S/C32H32ClN3O6S/c1-32(2,3)42-30(38)21-36(43(40,41)27-16-10-22-19-24(33)11-9-23(22)20-27)28-7-6-18-35(31(28)39)26-14-12-25(13-15-26)34-17-5-4-8-29(34)37/h4-5,8-17,19-20,28H,6-7,18,21H2,1-3H3