[2-oxidanylidene-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)ethyl] 3-bromanyl-4-methoxy-benzoate

Systemtic Name: [2-oxidanylidene-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)ethyl] 3-bromanyl-4-methoxy-benzoate Openeye Name: [2-oxo-2-(tetralin-1-ylamino)ethyl] 3-bromo-4-methoxy-benzoate CAS Name: 3-bromo-4-methoxybenzoic acid [2-oxo-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)ethyl] 3-bromo-4-methoxybenzoate Traditional Name: 3-bromo-4-methoxy-benzoic acid [2-keto-2-(tetralin-1-ylamino)ethyl] ester Formula: C20H20BrNO4 MolecularWeight: 418.2811

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OCC(=O)NC2CCCC3=CC=CC=C23)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OCC(=O)NC2CCCC3=CC=CC=C23)Br

InChI

InChI=1S/C20H20BrNO4/c1-25-18-10-9-14(11-16(18)21)20(24)26-12-19(23)22-17-8-4-6-13-5-2-3-7-15(13)17/h2-3,5,7,9-11,17H,4,6,8,12H2,1H3,(H,22,23)