(2-azanyl-2-oxidanylidene-ethyl) carbamate; 2,7-bis(phenylmethoxycarbonylamino)octanedioic acid

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) carbamate; 2,7-bis(phenylmethoxycarbonylamino)octanedioic acid Openeye Name: (2-amino-2-oxo-ethyl) carbamate; 2,7-bis(benzyloxycarbonylamino)octanedioic acid CAS Name: 2,7-bis(phenylmethoxycarbonylamino)octanedioic acid; carbamic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) carbamate; 2,7-bis(phenylmethoxycarbonylamino)octanedioic acid Traditional Name: 2,7-bis(benzyloxycarbonylamino)suberic acid; carbamic acid (2-amino-2-keto-ethyl) ester Formula: C30H40N6O14 MolecularWeight: 708.6704

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CCCCC(C(=O)O)NC(=O)OCC2=CC=CC=C2)C(=O)O.C(C(=O)N)OC(=O)N.C(C(=O)N)OC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CCCCC(C(=O)O)NC(=O)OCC2=CC=CC=C2)C(=O)O.C(C(=O)N)OC(=O)N.C(C(=O)N)OC(=O)N

InChI

InChI=1S/C24H28N2O8.2C3H6N2O3/c27-21(28)19(25-23(31)33-15-17-9-3-1-4-10-17)13-7-8-14-20(22(29)30)26-24(32)34-16-18-11-5-2-6-12-18;2*4-2(6)1-8-3(5)7/h1-6,9-12,19-20H,7-8,13-16H2,(H,25,31)(H,26,32)(H,27,28)(H,29,30);2*1H2,(H2,4,6)(H2,5,7)