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

Systemtic Name: [2-(dicyclohexylamino)-2-oxidanylidene-ethyl] 1,2,3,4-tetrahydroacridine-9-carboxylate Openeye Name: [2-(dicyclohexylamino)-2-oxo-ethyl] 1,2,3,4-tetrahydroacridine-9-carboxylate CAS Name: 1,2,3,4-tetrahydroacridine-9-carboxylic acid [2-(dicyclohexylamino)-2-oxoethyl] ester IUPAC Name: [2-(dicyclohexylamino)-2-oxoethyl] 1,2,3,4-tetrahydroacridine-9-carboxylate Traditional Name: 1,2,3,4-tetrahydroacridine-9-carboxylic acid [2-(dicyclohexylamino)-2-keto-ethyl] ester Formula: C28H36N2O3 MolecularWeight: 448.59704

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(C2CCCCC2)C(=O)COC(=O)C3=C4CCCCC4=NC5=CC=CC=C53

Isomeric SMILES

C1CCC(CC1)N(C2CCCCC2)C(=O)COC(=O)C3=C4CCCCC4=NC5=CC=CC=C53

InChI

InChI=1S/C28H36N2O3/c31-26(30(20-11-3-1-4-12-20)21-13-5-2-6-14-21)19-33-28(32)27-22-15-7-9-17-24(22)29-25-18-10-8-16-23(25)27/h7,9,15,17,20-21H,1-6,8,10-14,16,18-19H2