ethyl 2-[[(2R)-2-(2-adamantyloxycarbonylamino)-3-(1H-indol-3-yl)propanoyl]-phenethyl-amino]ethanoate

Systemtic Name: ethyl 2-[[(2R)-2-(2-adamantyloxycarbonylamino)-3-(1H-indol-3-yl)propanoyl]-phenethyl-amino]ethanoate Openeye Name: ethyl 2-[[(2R)-2-(2-adamantyloxycarbonylamino)-3-(1H-indol-3-yl)propanoyl]-phenethyl-amino]acetate CAS Name: 2-[[(2R)-2-[[2-adamantyloxy(oxo)methyl]amino]-3-(1H-indol-3-yl)-1-oxopropyl]-phenethylamino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[(2R)-2-(2-adamantyloxycarbonylamino)-3-(1H-indol-3-yl)propanoyl]-phenethylamino]acetate Traditional Name: 2-[[(2R)-2-(2-adamantyloxycarbonylamino)-3-(1H-indol-3-yl)propanoyl]-phenethyl-amino]acetic acid ethyl ester Formula: C34H41N3O5 MolecularWeight: 571.70644

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(CCC1=CC=CC=C1)C(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)OC4C5CC6CC(C5)CC4C6

Isomeric SMILES

CCOC(=O)CN(CCC1=CC=CC=C1)C(=O)[C@@H](CC2=CNC3=CC=CC=C32)NC(=O)OC4C5CC6CC(C5)CC4C6

InChI

InChI=1S/C34H41N3O5/c1-2-41-31(38)21-37(13-12-22-8-4-3-5-9-22)33(39)30(19-27-20-35-29-11-7-6-10-28(27)29)36-34(40)42-32-25-15-23-14-24(17-25)18-26(32)16-23/h3-11,20,23-26,30,32,35H,2,12-19,21H2,1H3,(H,36,40)/t23?,24?,25?,26?,30-,32?/m1/s1