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

Systemtic Name: tert-butyl N-[(2R)-3-(1H-indol-3-yl)-1-(3-methylbutylamino)-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1R)-1-(1H-indol-3-ylmethyl)-2-(isopentylamino)-2-oxo-ethyl]carbamate CAS Name: N-[(2R)-3-(1H-indol-3-yl)-1-(3-methylbutylamino)-1-oxopropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2R)-3-(1H-indol-3-yl)-1-(3-methylbutylamino)-1-oxopropan-2-yl]carbamate Traditional Name: N-[(1R)-1-(1H-indol-3-ylmethyl)-2-(isoamylamino)-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C21H31N3O3 MolecularWeight: 373.48914

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)CCNC(=O)[C@@H](CC1=CNC2=CC=CC=C21)NC(=O)OC(C)(C)C

InChI

InChI=1S/C21H31N3O3/c1-14(2)10-11-22-19(25)18(24-20(26)27-21(3,4)5)12-15-13-23-17-9-7-6-8-16(15)17/h6-9,13-14,18,23H,10-12H2,1-5H3,(H,22,25)(H,24,26)/t18-/m1/s1