ethyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanylidene-5-[1-(phenylsulfonyl)indol-2-yl]pentanoate

Systemtic Name: ethyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanylidene-5-[1-(phenylsulfonyl)indol-2-yl]pentanoate Openeye Name: ethyl (2S)-5-[1-(benzenesulfonyl)indol-2-yl]-2-(tert-butoxycarbonylamino)-5-oxo-pentanoate CAS Name: (2S)-5-[1-(benzenesulfonyl)-2-indolyl]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-oxopentanoic acid ethyl ester IUPAC Name: ethyl (2S)-5-[1-(benzenesulfonyl)indol-2-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxopentanoate Traditional Name: (2S)-5-(1-besylindol-2-yl)-2-(tert-butoxycarbonylamino)-5-keto-valeric acid ethyl ester Formula: C26H30N2O7S MolecularWeight: 514.5906

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC(=O)C1=CC2=CC=CC=C2N1S(=O)(=O)C3=CC=CC=C3)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)[C@H](CCC(=O)C1=CC2=CC=CC=C2N1S(=O)(=O)C3=CC=CC=C3)NC(=O)OC(C)(C)C

InChI

InChI=1S/C26H30N2O7S/c1-5-34-24(30)20(27-25(31)35-26(2,3)4)15-16-23(29)22-17-18-11-9-10-14-21(18)28(22)36(32,33)19-12-7-6-8-13-19/h6-14,17,20H,5,15-16H2,1-4H3,(H,27,31)/t20-/m0/s1