4-azanylbutyl N-[(2S)-3-(1H-indol-3-yl)-1-oxidanylidene-1-(phenethylamino)propan-2-yl]carbamate

Systemtic Name: 4-azanylbutyl N-[(2S)-3-(1H-indol-3-yl)-1-oxidanylidene-1-(phenethylamino)propan-2-yl]carbamate Openeye Name: 4-aminobutyl N-[(1S)-1-(1H-indol-3-ylmethyl)-2-oxo-2-(phenethylamino)ethyl]carbamate CAS Name: N-[(2S)-3-(1H-indol-3-yl)-1-oxo-1-(phenethylamino)propan-2-yl]carbamic acid 4-aminobutyl ester IUPAC Name: 4-aminobutyl N-[(2S)-3-(1H-indol-3-yl)-1-oxo-1-(phenethylamino)propan-2-yl]carbamate Traditional Name: N-[(1S)-1-(1H-indol-3-ylmethyl)-2-keto-2-(phenethylamino)ethyl]carbamic acid 4-aminobutyl ester Formula: C24H30N4O3 MolecularWeight: 422.52

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)OCCCCN

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)[C@H](CC2=CNC3=CC=CC=C32)NC(=O)OCCCCN

InChI

InChI=1S/C24H30N4O3/c25-13-6-7-15-31-24(30)28-22(16-19-17-27-21-11-5-4-10-20(19)21)23(29)26-14-12-18-8-2-1-3-9-18/h1-5,8-11,17,22,27H,6-7,12-16,25H2,(H,26,29)(H,28,30)/t22-/m0/s1