1-(phenylmethoxycarbonylamino)cycloheptane-1-carboxylic acid

Systemtic Name: 1-(phenylmethoxycarbonylamino)cycloheptane-1-carboxylic acid Openeye Name: 1-(benzyloxycarbonylamino)cycloheptanecarboxylic acid CAS Name: 1-(phenylmethoxycarbonylamino)-1-cycloheptanecarboxylic acid IUPAC Name: 1-(phenylmethoxycarbonylamino)cycloheptane-1-carboxylic acid Traditional Name: 1-(benzyloxycarbonylamino)cycloheptanecarboxylic acid Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)(C(=O)O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1CCCC(CC1)(C(=O)O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C16H21NO4/c18-14(19)16(10-6-1-2-7-11-16)17-15(20)21-12-13-8-4-3-5-9-13/h3-5,8-9H,1-2,6-7,10-12H2,(H,17,20)(H,18,19)