tert-butyl 2-azanyl-2-[7-oxidanylidene-1-(1-oxidanylidene-1-phenylmethoxy-propan-2-yl)-3,6-dihydro-2H-azepin-4-yl]propanoate

Systemtic Name: tert-butyl 2-azanyl-2-[7-oxidanylidene-1-(1-oxidanylidene-1-phenylmethoxy-propan-2-yl)-3,6-dihydro-2H-azepin-4-yl]propanoate Openeye Name: tert-butyl 2-amino-2-[1-(2-benzyloxy-1-methyl-2-oxo-ethyl)-7-oxo-3,6-dihydro-2H-azepin-4-yl]propanoate CAS Name: 2-amino-2-[7-oxo-1-(1-oxo-1-phenylmethoxypropan-2-yl)-3,6-dihydro-2H-azepin-4-yl]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-amino-2-[7-oxo-1-(1-oxo-1-phenylmethoxypropan-2-yl)-3,6-dihydro-2H-azepin-4-yl]propanoate Traditional Name: 2-amino-2-[1-(2-benzoxy-2-keto-1-methyl-ethyl)-7-keto-3,6-dihydro-2H-azepin-4-yl]propionic acid tert-butyl ester Formula: C23H32N2O5 MolecularWeight: 416.51058

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC1=CC=CC=C1)N2CCC(=CCC2=O)C(C)(C(=O)OC(C)(C)C)N

Isomeric SMILES

CC(C(=O)OCC1=CC=CC=C1)N2CCC(=CCC2=O)C(C)(C(=O)OC(C)(C)C)N

InChI

InChI=1S/C23H32N2O5/c1-16(20(27)29-15-17-9-7-6-8-10-17)25-14-13-18(11-12-19(25)26)23(5,24)21(28)30-22(2,3)4/h6-11,16H,12-15,24H2,1-5H3