methyl 7-[ethoxycarbonyl-(ethoxycarbonylamino)amino]-7-(4-fluorophenyl)heptanoate

Systemtic Name: methyl 7-[ethoxycarbonyl-(ethoxycarbonylamino)amino]-7-(4-fluorophenyl)heptanoate Openeye Name: methyl 7-[ethoxycarbonyl-(ethoxycarbonylamino)amino]-7-(4-fluorophenyl)heptanoate CAS Name: 7-[ethoxycarbonyl-(ethoxycarbonylamino)amino]-7-(4-fluorophenyl)heptanoic acid methyl ester IUPAC Name: methyl 7-[ethoxycarbonyl-(ethoxycarbonylamino)amino]-7-(4-fluorophenyl)heptanoate Traditional Name: 7-[carbethoxy-(carbethoxyamino)amino]-7-(4-fluorophenyl)enanthic acid methyl ester Formula: C20H29FN2O6 MolecularWeight: 412.452463

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NN(C(CCCCCC(=O)OC)C1=CC=C(C=C1)F)C(=O)OCC

Isomeric SMILES

CCOC(=O)NN(C(CCCCCC(=O)OC)C1=CC=C(C=C1)F)C(=O)OCC

InChI

InChI=1S/C20H29FN2O6/c1-4-28-19(25)22-23(20(26)29-5-2)17(15-11-13-16(21)14-12-15)9-7-6-8-10-18(24)27-3/h11-14,17H,4-10H2,1-3H3,(H,22,25)