[2-oxidanylidene-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)ethyl] 3,4-dimethoxybenzoate

Systemtic Name: [2-oxidanylidene-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)ethyl] 3,4-dimethoxybenzoate Openeye Name: [2-oxo-2-(tetralin-1-ylamino)ethyl] 3,4-dimethoxybenzoate CAS Name: 3,4-dimethoxybenzoic 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] 3,4-dimethoxybenzoate Traditional Name: 3,4-dimethoxybenzoic acid [2-keto-2-(tetralin-1-ylamino)ethyl] ester Formula: C21H23NO5 MolecularWeight: 369.41102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23NO5/c1-25-18-11-10-15(12-19(18)26-2)21(24)27-13-20(23)22-17-9-5-7-14-6-3-4-8-16(14)17/h3-4,6,8,10-12,17H,5,7,9,13H2,1-2H3,(H,22,23)