3-[3-[(4-methylcyclohexyl)amino]-3-oxidanylidene-propyl]-4-oxidanylidene-phthalazin-1-olate

Systemtic Name: 3-[3-[(4-methylcyclohexyl)amino]-3-oxidanylidene-propyl]-4-oxidanylidene-phthalazin-1-olate Openeye Name: 3-[3-[(4-methylcyclohexyl)amino]-3-oxo-propyl]-4-oxo-phthalazin-1-olate CAS Name: 3-[3-[(4-methylcyclohexyl)amino]-3-oxopropyl]-4-oxo-1-phthalazinolate IUPAC Name: 3-[3-[(4-methylcyclohexyl)amino]-3-oxopropyl]-4-oxophthalazin-1-olate Traditional Name: 4-keto-3-[3-keto-3-[(4-methylcyclohexyl)amino]propyl]phthalazin-1-olate Formula: C18H22N3O3- MolecularWeight: 328.38558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)NC(=O)CCN2C(=O)C3=CC=CC=C3C(=N2)[O-]

Isomeric SMILES

CC1CCC(CC1)NC(=O)CCN2C(=O)C3=CC=CC=C3C(=N2)[O-]

InChI

InChI=1S/C18H23N3O3/c1-12-6-8-13(9-7-12)19-16(22)10-11-21-18(24)15-5-3-2-4-14(15)17(23)20-21/h2-5,12-13H,6-11H2,1H3,(H,19,22)(H,20,23)/p-1