[2-(2-methylpropylcarbamoylamino)-2-oxidanylidene-ethyl] 2-methyl-4-(phenylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate

Systemtic Name: [2-(2-methylpropylcarbamoylamino)-2-oxidanylidene-ethyl] 2-methyl-4-(phenylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: [2-(isobutylcarbamoylamino)-2-oxo-ethyl] 4-benzylidene-2-methyl-2,3-dihydro-1H-acridine-9-carboxylate CAS Name: 2-methyl-4-(phenylmethylene)-2,3-dihydro-1H-acridine-9-carboxylic acid [2-[[(2-methylpropylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(2-methylpropylcarbamoylamino)-2-oxoethyl] 4-benzylidene-2-methyl-2,3-dihydro-1H-acridine-9-carboxylate Traditional Name: 4-benzal-2-methyl-2,3-dihydro-1H-acridine-9-carboxylic acid [2-(isobutylcarbamoylamino)-2-keto-ethyl] ester Formula: C29H31N3O4 MolecularWeight: 485.57414

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=CC2=CC=CC=C2)C3=NC4=CC=CC=C4C(=C3C1)C(=O)OCC(=O)NC(=O)NCC(C)C

Isomeric SMILES

CC1CC(=CC2=CC=CC=C2)C3=NC4=CC=CC=C4C(=C3C1)C(=O)OCC(=O)NC(=O)NCC(C)C

InChI

InChI=1S/C29H31N3O4/c1-18(2)16-30-29(35)32-25(33)17-36-28(34)26-22-11-7-8-12-24(22)31-27-21(13-19(3)14-23(26)27)15-20-9-5-4-6-10-20/h4-12,15,18-19H,13-14,16-17H2,1-3H3,(H2,30,32,33,35)