O4-ethyl O1-(phenylmethyl) 4-isocyanatopiperidine-1,4-dicarboxylate

Systemtic Name: O4-ethyl O1-(phenylmethyl) 4-isocyanatopiperidine-1,4-dicarboxylate Openeye Name: O1-benzyl O4-ethyl 4-isocyanatopiperidine-1,4-dicarboxylate CAS Name: 4-isocyanatopiperidine-1,4-dicarboxylic acid O4-ethyl ester O1-(phenylmethyl) ester IUPAC Name: 1-O-benzyl 4-O-ethyl 4-isocyanatopiperidine-1,4-dicarboxylate Traditional Name: 4-isocyanatopiperidine-1,4-dicarboxylic acid O1-benzyl ester O4-ethyl ester Formula: C17H20N2O5 MolecularWeight: 332.3511

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)C(=O)OCC2=CC=CC=C2)N=C=O

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)C(=O)OCC2=CC=CC=C2)N=C=O

InChI

InChI=1S/C17H20N2O5/c1-2-23-15(21)17(18-13-20)8-10-19(11-9-17)16(22)24-12-14-6-4-3-5-7-14/h3-7H,2,8-12H2,1H3