1-[[(1-hexadecylbenzimidazol-2-yl)amino]methylidene]-6-nitro-naphthalen-2-one

Systemtic Name: 1-[[(1-hexadecylbenzimidazol-2-yl)amino]methylidene]-6-nitro-naphthalen-2-one Openeye Name: 1-[[(1-hexadecylbenzimidazol-2-yl)amino]methylene]-6-nitro-naphthalen-2-one CAS Name: 1-[[(1-hexadecyl-2-benzimidazolyl)amino]methylidene]-6-nitro-2-naphthalenone IUPAC Name: 1-[[(1-hexadecylbenzimidazol-2-yl)amino]methylidene]-6-nitronaphthalen-2-one Traditional Name: 1-[[(1-cetylbenzimidazol-2-yl)amino]methylene]-6-nitro-naphthalen-2-one Formula: C34H44N4O3 MolecularWeight: 556.73816

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN1C2=CC=CC=C2N=C1NC=C3C4=C(C=CC3=O)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCN1C2=CC=CC=C2N=C1NC=C3C4=C(C=CC3=O)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C34H44N4O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-24-37-32-19-16-15-18-31(32)36-34(37)35-26-30-29-22-21-28(38(40)41)25-27(29)20-23-33(30)39/h15-16,18-23,25-26H,2-14,17,24H2,1H3,(H,35,36)