dimethyl 3-[[(2R)-2-(2-adamantyloxycarbonylamino)-3-(1H-indol-3-yl)-2-methyl-propanoyl]amino]pentanedioate

Systemtic Name: dimethyl 3-[[(2R)-2-(2-adamantyloxycarbonylamino)-3-(1H-indol-3-yl)-2-methyl-propanoyl]amino]pentanedioate Openeye Name: dimethyl 3-[[(2R)-2-(2-adamantyloxycarbonylamino)-3-(1H-indol-3-yl)-2-methyl-propanoyl]amino]pentanedioate CAS Name: 3-[[(2R)-2-[[2-adamantyloxy(oxo)methyl]amino]-3-(1H-indol-3-yl)-2-methyl-1-oxopropyl]amino]pentanedioic acid dimethyl ester IUPAC Name: dimethyl 3-[[(2R)-2-(2-adamantyloxycarbonylamino)-3-(1H-indol-3-yl)-2-methylpropanoyl]amino]pentanedioate Traditional Name: 3-[[(2R)-2-(2-adamantyloxycarbonylamino)-3-(1H-indol-3-yl)-2-methyl-propanoyl]amino]glutaric acid dimethyl ester Formula: C30H39N3O7 MolecularWeight: 553.64656

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CNC2=CC=CC=C21)(C(=O)NC(CC(=O)OC)CC(=O)OC)NC(=O)OC3C4CC5CC(C4)CC3C5

Isomeric SMILES

C[C@@](CC1=CNC2=CC=CC=C21)(C(=O)NC(CC(=O)OC)CC(=O)OC)NC(=O)OC3C4CC5CC(C4)CC3C5

InChI

InChI=1S/C30H39N3O7/c1-30(15-21-16-31-24-7-5-4-6-23(21)24,28(36)32-22(13-25(34)38-2)14-26(35)39-3)33-29(37)40-27-19-9-17-8-18(11-19)12-20(27)10-17/h4-7,16-20,22,27,31H,8-15H2,1-3H3,(H,32,36)(H,33,37)/t17?,18?,19?,20?,27?,30-/m1/s1