2-[2-(cyclopentylmethyl)-3-(phenylmethoxycarbonylamino)propanoyl]-3,4-dihydropyridazine-1-carboxylic acid

Systemtic Name: 2-[2-(cyclopentylmethyl)-3-(phenylmethoxycarbonylamino)propanoyl]-3,4-dihydropyridazine-1-carboxylic acid Openeye Name: 2-[2-(benzyloxycarbonylaminomethyl)-3-cyclopentyl-propanoyl]-3,4-dihydropyridazine-1-carboxylic acid CAS Name: 2-[2-(cyclopentylmethyl)-1-oxo-3-(phenylmethoxycarbonylamino)propyl]-3,4-dihydropyridazine-1-carboxylic acid IUPAC Name: 2-[2-(cyclopentylmethyl)-3-(phenylmethoxycarbonylamino)propanoyl]-3,4-dihydropyridazine-1-carboxylic acid Traditional Name: 2-[2-(benzyloxycarbonylaminomethyl)-3-cyclopentyl-propanoyl]-3,4-dihydropyridazine-1-carboxylic acid Formula: C22H29N3O5 MolecularWeight: 415.48276

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CC(CNC(=O)OCC2=CC=CC=C2)C(=O)N3CCC=CN3C(=O)O

Isomeric SMILES

C1CCC(C1)CC(CNC(=O)OCC2=CC=CC=C2)C(=O)N3CCC=CN3C(=O)O

InChI

InChI=1S/C22H29N3O5/c26-20(24-12-6-7-13-25(24)22(28)29)19(14-17-8-4-5-9-17)15-23-21(27)30-16-18-10-2-1-3-11-18/h1-3,7,10-11,13,17,19H,4-6,8-9,12,14-16H2,(H,23,27)(H,28,29)