2-methylpropyl N-[(2S)-1-(2-hydroxyethylamino)-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: 2-methylpropyl N-[(2S)-1-(2-hydroxyethylamino)-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: isobutyl N-[(1S)-2-(2-hydroxyethylamino)-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]carbamate CAS Name: N-[(2S)-1-(2-hydroxyethylamino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl N-[(2S)-1-(2-hydroxyethylamino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate Traditional Name: N-[(1S)-2-(2-hydroxyethylamino)-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]carbamic acid isobutyl ester Formula: C18H25N3O4 MolecularWeight: 347.4088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)NCCO

Isomeric SMILES

CC(C)COC(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)NCCO

InChI

InChI=1S/C18H25N3O4/c1-12(2)11-25-18(24)21-16(17(23)19-7-8-22)9-13-10-20-15-6-4-3-5-14(13)15/h3-6,10,12,16,20,22H,7-9,11H2,1-2H3,(H,19,23)(H,21,24)/t16-/m0/s1