dimethyl 4-methyl-7-oxidanylidene-1-(phenylmethyl)azepane-2,4-dicarboxylate

Systemtic Name: dimethyl 4-methyl-7-oxidanylidene-1-(phenylmethyl)azepane-2,4-dicarboxylate Openeye Name: dimethyl 1-benzyl-4-methyl-7-oxo-azepane-2,4-dicarboxylate CAS Name: 4-methyl-7-oxo-1-(phenylmethyl)azepane-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-benzyl-4-methyl-7-oxoazepane-2,4-dicarboxylate Traditional Name: 1-benzyl-7-keto-4-methyl-azepane-2,4-dicarboxylic acid dimethyl ester Formula: C18H23NO5 MolecularWeight: 333.37892

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(=O)N(C(C1)C(=O)OC)CC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC1(CCC(=O)N(C(C1)C(=O)OC)CC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C18H23NO5/c1-18(17(22)24-3)10-9-15(20)19(14(11-18)16(21)23-2)12-13-7-5-4-6-8-13/h4-8,14H,9-12H2,1-3H3