1-hexadecyl-3-methyl-5-phenylazanyl-indazole-4,7-dione

Systemtic Name: 1-hexadecyl-3-methyl-5-phenylazanyl-indazole-4,7-dione Openeye Name: 5-anilino-1-hexadecyl-3-methyl-indazole-4,7-dione CAS Name: 5-anilino-1-hexadecyl-3-methylindazole-4,7-dione IUPAC Name: 5-anilino-1-hexadecyl-3-methylindazole-4,7-dione Traditional Name: 5-anilino-1-cetyl-3-methyl-indazole-4,7-quinone Formula: C30H43N3O2 MolecularWeight: 477.68132

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN1C2=C(C(=N1)C)C(=O)C(=CC2=O)NC3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCCCCCCCN1C2=C(C(=N1)C)C(=O)C(=CC2=O)NC3=CC=CC=C3

InChI

InChI=1S/C30H43N3O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-33-29-27(34)23-26(30(35)28(29)24(2)32-33)31-25-20-17-16-18-21-25/h16-18,20-21,23,31H,3-15,19,22H2,1-2H3