1-(2-chloroethyl)-3-[3-(5-oxidanylpent-1-ynyl)phenyl]urea

Systemtic Name: 1-(2-chloroethyl)-3-[3-(5-oxidanylpent-1-ynyl)phenyl]urea Openeye Name: 1-(2-chloroethyl)-3-[3-(5-hydroxypent-1-ynyl)phenyl]urea CAS Name: 1-(2-chloroethyl)-3-[3-(5-hydroxypent-1-ynyl)phenyl]urea IUPAC Name: 1-(2-chloroethyl)-3-[3-(5-hydroxypent-1-ynyl)phenyl]urea Traditional Name: 1-(2-chloroethyl)-3-[3-(5-hydroxypent-1-ynyl)phenyl]urea Formula: C14H17ClN2O2 MolecularWeight: 280.74998

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)NCCCl)C#CCCCO

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)NCCCl)C#CCCCO

InChI

InChI=1S/C14H17ClN2O2/c15-8-9-16-14(19)17-13-7-4-6-12(11-13)5-2-1-3-10-18/h4,6-7,11,18H,1,3,8-10H2,(H2,16,17,19)