azanyl 3-[2-(1-adamantylcarbonylamino)-4-azanyl-4-oxidanylidene-butanoyl]-2-oxidanyl-1-(4-phenylbutyl)pyrrolidine-2-carboxylate

Systemtic Name: azanyl 3-[2-(1-adamantylcarbonylamino)-4-azanyl-4-oxidanylidene-butanoyl]-2-oxidanyl-1-(4-phenylbutyl)pyrrolidine-2-carboxylate Openeye Name: amino 3-[2-(adamantane-1-carbonylamino)-4-amino-4-oxo-butanoyl]-2-hydroxy-1-(4-phenylbutyl)pyrrolidine-2-carboxylate CAS Name: 3-[2-[[1-adamantyl(oxo)methyl]amino]-4-amino-1,4-dioxobutyl]-2-hydroxy-1-(4-phenylbutyl)-2-pyrrolidinecarboxylic acid amino ester IUPAC Name: amino 3-[2-(adamantane-1-carbonylamino)-4-amino-4-oxobutanoyl]-2-hydroxy-1-(4-phenylbutyl)pyrrolidine-2-carboxylate Traditional Name: 3-[2-(adamantane-1-carbonylamino)-4-amino-4-keto-butanoyl]-2-hydroxy-1-(4-phenylbutyl)pyrrolidine-2-carboxylic acid amino ester Formula: C30H42N4O6 MolecularWeight: 554.67768

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C1C(=O)C(CC(=O)N)NC(=O)C23CC4CC(C2)CC(C4)C3)(C(=O)ON)O)CCCCC5=CC=CC=C5

Isomeric SMILES

C1CN(C(C1C(=O)C(CC(=O)N)NC(=O)C23CC4CC(C2)CC(C4)C3)(C(=O)ON)O)CCCCC5=CC=CC=C5

InChI

InChI=1S/C30H42N4O6/c31-25(35)15-24(33-27(37)29-16-20-12-21(17-29)14-22(13-20)18-29)26(36)23-9-11-34(30(23,39)28(38)40-32)10-5-4-8-19-6-2-1-3-7-19/h1-3,6-7,20-24,39H,4-5,8-18,32H2,(H2,31,35)(H,33,37)