ethyl 2-[[1-(1-ethoxy-1-oxidanylidene-propan-2-yl)-2-oxidanylidene-azepan-3-yl]amino]-4-phenyl-butanoate

Systemtic Name: ethyl 2-[[1-(1-ethoxy-1-oxidanylidene-propan-2-yl)-2-oxidanylidene-azepan-3-yl]amino]-4-phenyl-butanoate Openeye Name: ethyl 2-[[1-(2-ethoxy-1-methyl-2-oxo-ethyl)-2-oxo-azepan-3-yl]amino]-4-phenyl-butanoate CAS Name: 2-[[1-(1-ethoxy-1-oxopropan-2-yl)-2-oxo-3-azepanyl]amino]-4-phenylbutanoic acid ethyl ester IUPAC Name: ethyl 2-[[1-(1-ethoxy-1-oxopropan-2-yl)-2-oxoazepan-3-yl]amino]-4-phenylbutanoate Traditional Name: 2-[[1-(2-ethoxy-2-keto-1-methyl-ethyl)-2-keto-azepan-3-yl]amino]-4-phenyl-butyric acid ethyl ester Formula: C23H34N2O5 MolecularWeight: 418.52646

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)N1CCCCC(C1=O)NC(CCC2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C)N1CCCCC(C1=O)NC(CCC2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C23H34N2O5/c1-4-29-22(27)17(3)25-16-10-9-13-19(21(25)26)24-20(23(28)30-5-2)15-14-18-11-7-6-8-12-18/h6-8,11-12,17,19-20,24H,4-5,9-10,13-16H2,1-3H3