[2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 1,2,3,4-tetrahydroacridine-9-carboxylate

Systemtic Name: [2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 1,2,3,4-tetrahydroacridine-9-carboxylate Openeye Name: [2-(isopentylcarbamoylamino)-2-oxo-ethyl] 1,2,3,4-tetrahydroacridine-9-carboxylate CAS Name: 1,2,3,4-tetrahydroacridine-9-carboxylic acid [2-[[(3-methylbutylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylcarbamoylamino)-2-oxoethyl] 1,2,3,4-tetrahydroacridine-9-carboxylate Traditional Name: 1,2,3,4-tetrahydroacridine-9-carboxylic acid [2-(isoamylcarbamoylamino)-2-keto-ethyl] ester Formula: C22H27N3O4 MolecularWeight: 397.46748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)NC(=O)COC(=O)C1=C2CCCCC2=NC3=CC=CC=C31

Isomeric SMILES

CC(C)CCNC(=O)NC(=O)COC(=O)C1=C2CCCCC2=NC3=CC=CC=C31

InChI

InChI=1S/C22H27N3O4/c1-14(2)11-12-23-22(28)25-19(26)13-29-21(27)20-15-7-3-5-9-17(15)24-18-10-6-4-8-16(18)20/h3,5,7,9,14H,4,6,8,10-13H2,1-2H3,(H2,23,25,26,28)