[1-oxidanylidene-1-(1,2,3,4-tetrahydronaphthalen-1-ylamino)propan-2-yl] 4-bromanylbenzoate

Systemtic Name: [1-oxidanylidene-1-(1,2,3,4-tetrahydronaphthalen-1-ylamino)propan-2-yl] 4-bromanylbenzoate Openeye Name: [1-methyl-2-oxo-2-(tetralin-1-ylamino)ethyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [1-oxo-1-(1,2,3,4-tetrahydronaphthalen-1-ylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(1,2,3,4-tetrahydronaphthalen-1-ylamino)propan-2-yl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [2-keto-1-methyl-2-(tetralin-1-ylamino)ethyl] ester Formula: C20H20BrNO3 MolecularWeight: 402.2817

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCC2=CC=CC=C12)OC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC(C(=O)NC1CCCC2=CC=CC=C12)OC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H20BrNO3/c1-13(25-20(24)15-9-11-16(21)12-10-15)19(23)22-18-8-4-6-14-5-2-3-7-17(14)18/h2-3,5,7,9-13,18H,4,6,8H2,1H3,(H,22,23)