tert-butyl 4-[naphthalen-2-ylmethyl-(3-propan-2-ylsulfonylphenyl)amino]-2,4-bis(oxidanylidene)butanoate

Systemtic Name: tert-butyl 4-[naphthalen-2-ylmethyl-(3-propan-2-ylsulfonylphenyl)amino]-2,4-bis(oxidanylidene)butanoate Openeye Name: tert-butyl 4-[3-isopropylsulfonyl-N-(2-naphthylmethyl)anilino]-2,4-dioxo-butanoate CAS Name: 4-[N-(2-naphthalenylmethyl)-3-propan-2-ylsulfonylanilino]-2,4-dioxobutanoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[N-(naphthalen-2-ylmethyl)-3-propan-2-ylsulfonylanilino]-2,4-dioxobutanoate Traditional Name: 4-[3-isopropylsulfonyl-N-(2-naphthylmethyl)anilino]-2,4-diketo-butyric acid tert-butyl ester Formula: C28H31NO6S MolecularWeight: 509.61384

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=CC=CC(=C1)N(CC2=CC3=CC=CC=C3C=C2)C(=O)CC(=O)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)S(=O)(=O)C1=CC=CC(=C1)N(CC2=CC3=CC=CC=C3C=C2)C(=O)CC(=O)C(=O)OC(C)(C)C

InChI

InChI=1S/C28H31NO6S/c1-19(2)36(33,34)24-12-8-11-23(16-24)29(26(31)17-25(30)27(32)35-28(3,4)5)18-20-13-14-21-9-6-7-10-22(21)15-20/h6-16,19H,17-18H2,1-5H3