1,3-bis(1-adamantylcarbonylamino)propan-2-yl 2-(phenylmethoxycarbonylamino)ethanoate

Systemtic Name: 1,3-bis(1-adamantylcarbonylamino)propan-2-yl 2-(phenylmethoxycarbonylamino)ethanoate Openeye Name: [2-(adamantane-1-carbonylamino)-1-[(adamantane-1-carbonylamino)methyl]ethyl] 2-(benzyloxycarbonylamino)acetate CAS Name: 2-(phenylmethoxycarbonylamino)acetic acid 1,3-bis[[1-adamantyl(oxo)methyl]amino]propan-2-yl ester IUPAC Name: 1,3-bis(adamantane-1-carbonylamino)propan-2-yl 2-(phenylmethoxycarbonylamino)acetate Traditional Name: 2-(benzyloxycarbonylamino)acetic acid [2-(adamantane-1-carbonylamino)-1-[(adamantane-1-carbonylamino)methyl]ethyl] ester Formula: C35H47N3O6 MolecularWeight: 605.76418

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NCC(CNC(=O)C45CC6CC(C4)CC(C6)C5)OC(=O)CNC(=O)OCC7=CC=CC=C7

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NCC(CNC(=O)C45CC6CC(C4)CC(C6)C5)OC(=O)CNC(=O)OCC7=CC=CC=C7

InChI

InChI=1S/C35H47N3O6/c39-30(20-38-33(42)43-21-22-4-2-1-3-5-22)44-29(18-36-31(40)34-12-23-6-24(13-34)8-25(7-23)14-34)19-37-32(41)35-15-26-9-27(16-35)11-28(10-26)17-35/h1-5,23-29H,6-21H2,(H,36,40)(H,37,41)(H,38,42)