9H-fluoren-9-ylmethyl N-[(2S)-3-(1H-indol-3-yl)-1-(3-methylbutylamino)-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: 9H-fluoren-9-ylmethyl N-[(2S)-3-(1H-indol-3-yl)-1-(3-methylbutylamino)-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: 9H-fluoren-9-ylmethyl N-[(1S)-1-(1H-indol-3-ylmethyl)-2-(isopentylamino)-2-oxo-ethyl]carbamate CAS Name: N-[(2S)-3-(1H-indol-3-yl)-1-(3-methylbutylamino)-1-oxopropan-2-yl]carbamic acid 9H-fluoren-9-ylmethyl ester IUPAC Name: 9H-fluoren-9-ylmethyl N-[(2S)-3-(1H-indol-3-yl)-1-(3-methylbutylamino)-1-oxopropan-2-yl]carbamate Traditional Name: N-[(1S)-1-(1H-indol-3-ylmethyl)-2-(isoamylamino)-2-keto-ethyl]carbamic acid 9H-fluoren-9-ylmethyl ester Formula: C31H33N3O3 MolecularWeight: 495.61202

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

Isomeric SMILES

CC(C)CCNC(=O)[C@H](CC1=CNC2=CC=CC=C21)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

InChI

InChI=1S/C31H33N3O3/c1-20(2)15-16-32-30(35)29(17-21-18-33-28-14-8-7-9-22(21)28)34-31(36)37-19-27-25-12-5-3-10-23(25)24-11-4-6-13-26(24)27/h3-14,18,20,27,29,33H,15-17,19H2,1-2H3,(H,32,35)(H,34,36)/t29-/m0/s1