[1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylate

Systemtic Name: [1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylate Openeye Name: (1-allophanoyl-2-methyl-propyl) 7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylate CAS Name: 7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] 7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylate Traditional Name: 7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid (1-allophanoyl-2-methyl-propyl) ester Formula: C21H25N3O4 MolecularWeight: 383.4409

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C3=C(CCCC3)N=C2C=C1)C(=O)OC(C(C)C)C(=O)NC(=O)N

Isomeric SMILES

CC1=CC2=C(C3=C(CCCC3)N=C2C=C1)C(=O)OC(C(C)C)C(=O)NC(=O)N

InChI

InChI=1S/C21H25N3O4/c1-11(2)18(19(25)24-21(22)27)28-20(26)17-13-6-4-5-7-15(13)23-16-9-8-12(3)10-14(16)17/h8-11,18H,4-7H2,1-3H3,(H3,22,24,25,27)