[2-(azocan-1-yl)-2-oxidanylidene-ethyl] 3-(aminocarbonylamino)benzoate

Systemtic Name: [2-(azocan-1-yl)-2-oxidanylidene-ethyl] 3-(aminocarbonylamino)benzoate Openeye Name: [2-(azocan-1-yl)-2-oxo-ethyl] 3-ureidobenzoate CAS Name: 3-(carbamoylamino)benzoic acid [2-(1-azocanyl)-2-oxoethyl] ester IUPAC Name: [2-(azocan-1-yl)-2-oxoethyl] 3-(carbamoylamino)benzoate Traditional Name: 3-ureidobenzoic acid [2-(azocan-1-yl)-2-keto-ethyl] ester Formula: C17H23N3O4 MolecularWeight: 333.38222

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)C(=O)COC(=O)C2=CC(=CC=C2)NC(=O)N

Isomeric SMILES

C1CCCN(CCC1)C(=O)COC(=O)C2=CC(=CC=C2)NC(=O)N

InChI

InChI=1S/C17H23N3O4/c18-17(23)19-14-8-6-7-13(11-14)16(22)24-12-15(21)20-9-4-2-1-3-5-10-20/h6-8,11H,1-5,9-10,12H2,(H3,18,19,23)