2-[[3-(cyclohex-3-en-1-ylmethoxy)-2-oxidanyl-propyl]carbamoyl]benzoic acid

Systemtic Name: 2-[[3-(cyclohex-3-en-1-ylmethoxy)-2-oxidanyl-propyl]carbamoyl]benzoic acid Openeye Name: 2-[[3-(cyclohex-3-en-1-ylmethoxy)-2-hydroxy-propyl]carbamoyl]benzoic acid CAS Name: 2-[[[3-(1-cyclohex-3-enylmethoxy)-2-hydroxypropyl]amino]-oxomethyl]benzoic acid IUPAC Name: 2-[[3-(cyclohex-3-en-1-ylmethoxy)-2-hydroxypropyl]carbamoyl]benzoic acid Traditional Name: 2-[[3-(cyclohex-3-en-1-ylmethoxy)-2-hydroxy-propyl]carbamoyl]benzoic acid Formula: C18H23NO5 MolecularWeight: 333.37892

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC=C1)COCC(CNC(=O)C2=CC=CC=C2C(=O)O)O

Isomeric SMILES

C1CC(CC=C1)COCC(CNC(=O)C2=CC=CC=C2C(=O)O)O

InChI

InChI=1S/C18H23NO5/c20-14(12-24-11-13-6-2-1-3-7-13)10-19-17(21)15-8-4-5-9-16(15)18(22)23/h1-2,4-5,8-9,13-14,20H,3,6-7,10-12H2,(H,19,21)(H,22,23)