(6Z)-2-bromanyl-4-chloranyl-6-[[(1-hexadecylbenzimidazol-2-yl)amino]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6Z)-2-bromanyl-4-chloranyl-6-[[(1-hexadecylbenzimidazol-2-yl)amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-2-bromo-4-chloro-6-[[(1-hexadecylbenzimidazol-2-yl)amino]methylene]cyclohexa-2,4-dien-1-one CAS Name: (6Z)-2-bromo-4-chloro-6-[[(1-hexadecyl-2-benzimidazolyl)amino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6Z)-2-bromo-4-chloro-6-[[(1-hexadecylbenzimidazol-2-yl)amino]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6Z)-2-bromo-6-[[(1-cetylbenzimidazol-2-yl)amino]methylene]-4-chloro-cyclohexa-2,4-dien-1-one Formula: C30H41BrClN3O MolecularWeight: 575.02304

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN1C2=CC=CC=C2N=C1NC=C3C=C(C=C(C3=O)Br)Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCN1C2=CC=CC=C2N=C1N/C=C\3/C=C(C=C(C3=O)Br)Cl

InChI

InChI=1S/C30H41BrClN3O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-20-35-28-19-16-15-18-27(28)34-30(35)33-23-24-21-25(32)22-26(31)29(24)36/h15-16,18-19,21-23H,2-14,17,20H2,1H3,(H,33,34)/b24-23-