tert-butyl N-[3-(1H-indol-3-yl)-1-(7-oxidanylheptylamino)-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[3-(1H-indol-3-yl)-1-(7-oxidanylheptylamino)-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: tert-butyl N-[2-(7-hydroxyheptylamino)-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]carbamate CAS Name: N-[1-(7-hydroxyheptylamino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-(7-hydroxyheptylamino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate Traditional Name: N-[2-(7-hydroxyheptylamino)-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C23H35N3O4 MolecularWeight: 417.5417

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)NCCCCCCCO

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)NCCCCCCCO

InChI

InChI=1S/C23H35N3O4/c1-23(2,3)30-22(29)26-20(21(28)24-13-9-5-4-6-10-14-27)15-17-16-25-19-12-8-7-11-18(17)19/h7-8,11-12,16,20,25,27H,4-6,9-10,13-15H2,1-3H3,(H,24,28)(H,26,29)