2-[4-[3-(4-cyclopropylcarbonylphenoxy)propyl]piperazin-1-yl]carbonylazetidine-1-carboxylic acid

Systemtic Name: 2-[4-[3-(4-cyclopropylcarbonylphenoxy)propyl]piperazin-1-yl]carbonylazetidine-1-carboxylic acid Openeye Name: 2-[4-[3-[4-(cyclopropanecarbonyl)phenoxy]propyl]piperazine-1-carbonyl]azetidine-1-carboxylic acid CAS Name: 2-[[4-[3-[4-[cyclopropyl(oxo)methyl]phenoxy]propyl]-1-piperazinyl]-oxomethyl]-1-azetidinecarboxylic acid IUPAC Name: 2-[4-[3-[4-(cyclopropanecarbonyl)phenoxy]propyl]piperazine-1-carbonyl]azetidine-1-carboxylic acid Traditional Name: 2-[4-[3-[4-(cyclopropanecarbonyl)phenoxy]propyl]piperazine-1-carbonyl]azetidine-1-carboxylic acid Formula: C22H29N3O5 MolecularWeight: 415.48276

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)C2=CC=C(C=C2)OCCCN3CCN(CC3)C(=O)C4CCN4C(=O)O

Isomeric SMILES

C1CC1C(=O)C2=CC=C(C=C2)OCCCN3CCN(CC3)C(=O)C4CCN4C(=O)O

InChI

InChI=1S/C22H29N3O5/c26-20(16-2-3-16)17-4-6-18(7-5-17)30-15-1-9-23-11-13-24(14-12-23)21(27)19-8-10-25(19)22(28)29/h4-7,16,19H,1-3,8-15H2,(H,28,29)