[3-chloranyl-4-[3-(dimethylamino)prop-1-ynyl]phenyl]carbamic acid

Systemtic Name: [3-chloranyl-4-[3-(dimethylamino)prop-1-ynyl]phenyl]carbamic acid Openeye Name: [3-chloro-4-[3-(dimethylamino)prop-1-ynyl]phenyl]carbamic acid CAS Name: [3-chloro-4-[3-(dimethylamino)prop-1-ynyl]phenyl]carbamic acid IUPAC Name: [3-chloro-4-[3-(dimethylamino)prop-1-ynyl]phenyl]carbamic acid Traditional Name: [3-chloro-4-[3-(dimethylamino)prop-1-ynyl]phenyl]carbamic acid Formula: C12H13ClN2O2 MolecularWeight: 252.69682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC#CC1=C(C=C(C=C1)NC(=O)O)Cl

Isomeric SMILES

CN(C)CC#CC1=C(C=C(C=C1)NC(=O)O)Cl

InChI

InChI=1S/C12H13ClN2O2/c1-15(2)7-3-4-9-5-6-10(8-11(9)13)14-12(16)17/h5-6,8,14H,7H2,1-2H3,(H,16,17)