tert-butyl 4-[naphthalen-2-ylmethyl-(4-pyrrolidin-1-ylsulfonylphenyl)amino]-2,4-bis(oxidanylidene)butanoate

Systemtic Name: tert-butyl 4-[naphthalen-2-ylmethyl-(4-pyrrolidin-1-ylsulfonylphenyl)amino]-2,4-bis(oxidanylidene)butanoate Openeye Name: tert-butyl 4-[N-(2-naphthylmethyl)-4-pyrrolidin-1-ylsulfonyl-anilino]-2,4-dioxo-butanoate CAS Name: 4-[N-(2-naphthalenylmethyl)-4-(1-pyrrolidinylsulfonyl)anilino]-2,4-dioxobutanoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[N-(naphthalen-2-ylmethyl)-4-pyrrolidin-1-ylsulfonylanilino]-2,4-dioxobutanoate Traditional Name: 2,4-diketo-4-[N-(2-naphthylmethyl)-4-pyrrolidinosulfonyl-anilino]butyric acid tert-butyl ester Formula: C29H32N2O6S MolecularWeight: 536.63918

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(=O)CC(=O)N(CC1=CC2=CC=CC=C2C=C1)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC(C)(C)OC(=O)C(=O)CC(=O)N(CC1=CC2=CC=CC=C2C=C1)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C29H32N2O6S/c1-29(2,3)37-28(34)26(32)19-27(33)31(20-21-10-11-22-8-4-5-9-23(22)18-21)24-12-14-25(15-13-24)38(35,36)30-16-6-7-17-30/h4-5,8-15,18H,6-7,16-17,19-20H2,1-3H3