N-(cyclododecylideneamino)-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: N-(cyclododecylideneamino)-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-(cyclododecylideneamino)-4-oxo-phthalazine-1-carboxamide CAS Name: N-(cyclododecylideneamino)-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-(cyclododecylideneamino)-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-N-(cyclododecylideneamino)-4-keto-phthalazine-1-carboxamide Formula: C28H34N4O2 MolecularWeight: 458.59516

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCCCC(=NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4)CCCCC1

Isomeric SMILES

C1CCCCCC(=NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4)CCCCC1

InChI

InChI=1S/C28H34N4O2/c33-27(30-29-23-17-11-6-4-2-1-3-5-7-12-18-23)26-24-19-13-14-20-25(24)28(34)32(31-26)21-22-15-9-8-10-16-22/h8-10,13-16,19-20H,1-7,11-12,17-18,21H2,(H,30,33)