[2-(4-azanylbutanoyloxy)-4-[2-azanyl-3-[(2-methylpropan-2-yl)oxy]-3-oxidanylidene-propyl]phenyl] 4-azanylbutanoate

Systemtic Name: [2-(4-azanylbutanoyloxy)-4-[2-azanyl-3-[(2-methylpropan-2-yl)oxy]-3-oxidanylidene-propyl]phenyl] 4-azanylbutanoate Openeye Name: [2-(4-aminobutanoyloxy)-4-(2-amino-3-tert-butoxy-3-oxo-propyl)phenyl] 4-aminobutanoate CAS Name: 4-aminobutanoic acid [4-[2-amino-3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-2-(4-amino-1-oxobutoxy)phenyl] ester IUPAC Name: [2-(4-aminobutanoyloxy)-4-[2-amino-3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]phenyl] 4-aminobutanoate Traditional Name: 4-aminobutyric acid [2-(4-aminobutanoyloxy)-4-(2-amino-3-tert-butoxy-3-keto-propyl)phenyl] ester Formula: C21H33N3O6 MolecularWeight: 423.50322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CC1=CC(=C(C=C1)OC(=O)CCCN)OC(=O)CCCN)N

Isomeric SMILES

CC(C)(C)OC(=O)C(CC1=CC(=C(C=C1)OC(=O)CCCN)OC(=O)CCCN)N

InChI

InChI=1S/C21H33N3O6/c1-21(2,3)30-20(27)15(24)12-14-8-9-16(28-18(25)6-4-10-22)17(13-14)29-19(26)7-5-11-23/h8-9,13,15H,4-7,10-12,22-24H2,1-3H3