[1-[(2-methylcyclohexyl)amino]-1-oxidanylidene-propan-2-yl] 2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoate

Systemtic Name: [1-[(2-methylcyclohexyl)amino]-1-oxidanylidene-propan-2-yl] 2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoate Openeye Name: [1-methyl-2-[(2-methylcyclohexyl)amino]-2-oxo-ethyl] 2-(4-oxo-3H-phthalazin-1-yl)acetate CAS Name: 2-(4-oxo-3H-phthalazin-1-yl)acetic acid [1-[(2-methylcyclohexyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(2-methylcyclohexyl)amino]-1-oxopropan-2-yl] 2-(4-oxo-3H-phthalazin-1-yl)acetate Traditional Name: 2-(4-keto-3H-phthalazin-1-yl)acetic acid [2-keto-1-methyl-2-[(2-methylcyclohexyl)amino]ethyl] ester Formula: C20H25N3O4 MolecularWeight: 371.4302

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)C(C)OC(=O)CC2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CC1CCCCC1NC(=O)C(C)OC(=O)CC2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C20H25N3O4/c1-12-7-3-6-10-16(12)21-19(25)13(2)27-18(24)11-17-14-8-4-5-9-15(14)20(26)23-22-17/h4-5,8-9,12-13,16H,3,6-7,10-11H2,1-2H3,(H,21,25)(H,23,26)